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    isopentane
    CAS No.: 78-78-4 Formula: C5H12 Molecular Weight: 72.14880
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    isopentane

    CAS No.: 78-78-4 Formula: C5H12 Molecular Weight: 72.14880
    Suppliers: All (40) China Suppliers (40) Price Available (7) Contractor (3)

    Description

    Isopentane, C5H12, also called methylbutane or 2-methylbutane, is a branched-chain alkane with five carbon atoms. Isopentane is an extremely volatile and extremely flammable liquid at room temperature and pressure. The normal boiling point is just a few degrees above room temperature and isopentane will readily boil and evaporate away on a warm day. Isopentane is commonly used in conjunction with liquid nitrogen to achieve a liquid bath temperature of ?160°C. It is 1% or less of natural gas.

    Basic Info

    Chemical Name isopentane
    Synonyms

    Isopentan; 2-Methylbutane; Butane, 2-methyl-; Isoamylhydride; iso-pentane; iso-C5H12; 2-methyl-butane; methylbutane; ISOPROPENTANE; 2-methyl-butan; JJDW; 1,1-dimethylpropane; Expand

    CAS No. 78-78-4
    Molecular Formula C5H12
    Molecular Weight 72.14880
    PSA 0.00000
    LogP 2.05240

    Numbering system

    UNII ZH67814I0O

    Properties

    Appearance & Physical State colourless liquid with a characteristic smell
    Density 0.62
    Boiling Point 30oC
    Melting Point -160oC
    Flash Point -51oC
    Refractive Index 1.353-1.55
    Stability Stable. Extremely flammable. Incompatible with strong oxidizing agents. Vapour-air mixtures explosive in certain proportions. Incompatible with rubber, various plastics. The vapour, being heavier than air, may roll over surfaces and collect in low points.
    Storage Condition 2-8oC
    Vapor Density 2.6 (vs air)
    Vapor Pressure 11.17 psi ( 20 °C)

    Safety Info

    RTECS EK4430000
    Hazard Class 3
    Safety Statements S9-S16-S29-S33-S61-S62
    HS Code 2901100000
    WGK Germany 2
    Packing Group I
    RIDADR UN 1265
    Risk Statements R12; R51/53; R65; R66; R67
    Hazard Codes Xn
    Signal Word Danger
    Caution Statement P210; P261; P273; P301 + P310; P331
    Supplemental Hazard Statements Repeated exposure may cause skin dryness or cracking.
    Symbol GHS02, GHS07, GHS08, GHS09
    Hazard Declaration H224; H304; H336; H411
    SDS 1.0 Expand

    SDS 1.0

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    SAFETY DATA SHEETS

    According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

    Version: 1.0

    Creation Date: Aug 17, 2017

    Revision Date: Aug 17, 2017

    1.Identification

    1.1 GHS Product identifier

    Product name isopentane

    1.2 Other means of identification

    Product number -
    Other names iso-C5H12

    1.3 Recommended use of the chemical and restrictions on use

    Identified uses For industry use only. Fuels and fuel additives,Intermediates,Processing aids, not otherwise listed,Propellants and blowing agents
    Uses advised against no data available

    1.4 Supplier's details

    Company MOLBASE (Shanghai) Biotechnology Co., Ltd.
    Address Floor 4 & 5, Building 12, No. 1001 North Qinzhou Road,
    Xuhui District, Shanghai, China
    Telephone +86(21)64956998
    Fax +86(21)54365166

    1.5 Emergency phone number

    Emergency phone number +86-400-6021-666
    Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

    2.Hazard identification

    2.1 Classification of the substance or mixture

    Flammable liquids, Category 1

    Aspiration hazard, Category 1

    Specific target organ toxicity – single exposure, Category 3

    Hazardous to the aquatic environment, long-term (Chronic) - Category Chronic 2

    2.2 GHS label elements, including precautionary statements

    Pictogram(s)
    Signal word

    Danger

    Hazard statement(s)

    H224 Extremely flammable liquid and vapour

    H304 May be fatal if swallowed and enters airways

    H336 May cause drowsiness or dizziness

    H411 Toxic to aquatic life with long lasting effects

    Precautionary statement(s)
    Prevention

    P210 Keep away from heat, hot surfaces, sparks, open flames and other ignition sources. No smoking.

    P233 Keep container tightly closed.

    P240 Ground and bond container and receiving equipment.

    P241 Use explosion-proof [electrical/ventilating/lighting/...] equipment.

    P242 Use non-sparking tools.

    P243 Take action to prevent static discharges.

    P280 Wear protective gloves/protective clothing/eye protection/face protection.

    P261 Avoid breathing dust/fume/gas/mist/vapours/spray.

    P271 Use only outdoors or in a well-ventilated area.

    P273 Avoid release to the environment.

    Response

    P303+P361+P353 IF ON SKIN (or hair): Take off immediately all contaminated clothing. Rinse skin with water [or shower].

    P370+P378 In case of fire: Use ... to extinguish.

    P301+P310 IF SWALLOWED: Immediately call a POISON CENTER/doctor/…

    P331 Do NOT induce vomiting.

    P304+P340 IF INHALED: Remove person to fresh air and keep comfortable for breathing.

    P312 Call a POISON CENTER/doctor/…if you feel unwell.

    P391 Collect spillage.

    Storage

    P403+P235 Store in a well-ventilated place. Keep cool.

    P405 Store locked up.

    P403+P233 Store in a well-ventilated place. Keep container tightly closed.

    Disposal

    P501 Dispose of contents/container to ...

    2.3 Other hazards which do not result in classification

    none

    3.Composition/information on ingredients

    3.1 Substances

    Chemical name Common names and synonyms CAS number EC number Concentration
    isopentane isopentane 78-78-4 none 100%

    4.First-aid measures

    4.1 Description of necessary first-aid measures

    General advice

    Consult a physician. Show this safety data sheet to the doctor in attendance.

    If inhaled

    Fresh air, rest. Refer for medical attention.

    In case of skin contact

    First rinse with plenty of water for at least 15 minutes, then remove contaminated clothes and rinse again.

    In case of eye contact

    Rinse with plenty of water (remove contact lenses if easily possible).

    If swallowed

    Rinse mouth. Do NOT induce vomiting. Refer immediately for medical attention.

    4.2 Most important symptoms/effects, acute and delayed

    Inhalation causes irritation of respiratory tract, cough, mild depression, irregular heartbeat. Aspiration causes severe lung irritation, coughing, pulmonary edema; excitement followed by depression. Ingestion causes nausea, vomiting, swelling of abdomen, headache, depression. (USCG, 1999)

    4.3 Indication of immediate medical attention and special treatment needed, if necessary

    Basic treatment: Establish a patent airway (oropharyngeal or nasopharyngeal airway, if needed). Suction if necessary. Watch for signs of respiratory insufficiency and assist ventilations if necessary. Administer oxygen by nonrebreather mask at 10 to 15 L/min. Monitor for pulmonary edema and treat if necessary ... . Anticipate seizures and treat if necessary ... . For eye contamination, flush eyes immediately with water. Irrigate each eye continuously with 0.9% saline (NS) during transport ... . Do not use emetics. For ingestion, rinse mouth and administer 5 ml/kg up to 200 ml of water for dilution if the patient can swallow, has a strong gag reflex, and does not drool. Administer activated charcoal ... . Treat frostbite with rapid rewarming techniques ... ./Aliphatic hydrocarbons and related compounds/

    5.Fire-fighting measures

    5.1 Extinguishing media

    Suitable extinguishing media

    If material on fire or involved in fire: Do not extinguish fire unless flow can be stopped. Use water in flooding quantities as fog. Solid streams of water may spread fire. Cool all affected containers with flooding quantities of water. Apply water from as far a distance as possible. Use foam, dry chemical, or carbon dioxide. /Pentanes/

    5.2 Specific hazards arising from the chemical

    Behavior in Fire: Highly volatile liquid. Vapors may explode when mixed with air. (USCG, 1999)

    5.3 Special protective actions for fire-fighters

    Wear self-contained breathing apparatus for firefighting if necessary.

    6.Accidental release measures

    6.1 Personal precautions, protective equipment and emergency procedures

    Use personal protective equipment. Avoid dust formation. Avoid breathing vapours, mist or gas. Ensure adequate ventilation. Evacuate personnel to safe areas. Avoid breathing dust. For personal protection see section 8.

    6.2 Environmental precautions

    Evacuate danger area! Consult an expert! Personal protection: filter respirator for organic gases and vapours of low boiling point adapted to the airborne concentration of the substance. Remove all ignition sources. Do NOT let this chemical enter the environment. Collect leaking and spilled liquid in sealable containers as far as possible. Absorb remaining liquid in sand or inert absorbent. Then store and dispose of according to local regulations. Do NOT wash away into sewer.

    6.3 Methods and materials for containment and cleaning up

    Environmental considerations: air spill: Apply water spray or mist to knock down vapors. /Pentanes/

    7.Handling and storage

    7.1 Precautions for safe handling

    Avoid contact with skin and eyes. Avoid formation of dust and aerosols. Avoid exposure - obtain special instructions before use.Provide appropriate exhaust ventilation at places where dust is formed. For precautions see section 2.2.

    7.2 Conditions for safe storage, including any incompatibilities

    Fireproof. Well closed. Separated from strong oxidants. Store in an area without drain or sewer access. Provision to contain effluent from fire extinguishing.Fireproof. Well closed.

    8.Exposure controls/personal protection

    8.1 Control parameters

    Occupational Exposure limit values

    no data available

    Biological limit values

    no data available

    8.2 Appropriate engineering controls

    Handle in accordance with good industrial hygiene and safety practice. Wash hands before breaks and at the end of workday.

    8.3 Individual protection measures, such as personal protective equipment (PPE)

    Eye/face protection

    Safety glasses with side-shields conforming to EN166. Use equipment for eye protection tested and approved under appropriate government standards such as NIOSH (US) or EN 166(EU).

    Skin protection

    Wear impervious clothing. The type of protective equipment must be selected according to the concentration and amount of the dangerous substance at the specific workplace. Handle with gloves. Gloves must be inspected prior to use. Use proper glove removal technique(without touching glove's outer surface) to avoid skin contact with this product. Dispose of contaminated gloves after use in accordance with applicable laws and good laboratory practices. Wash and dry hands. The selected protective gloves have to satisfy the specifications of EU Directive 89/686/EEC and the standard EN 374 derived from it.

    Respiratory protection

    Wear dust mask when handling large quantities.

    Thermal hazards

    no data available

    9.Physical and chemical properties

    Physical state colourless liquid with a characteristic smell
    Colour Volatile liquid or gas
    Odour PLEASANT ODOR
    Melting point/ freezing point -160oC
    Boiling point or initial boiling point and boiling range 30°C(lit.)
    Flammability Extremely flammable. Heating will cause rise in pressure with risk of bursting.
    Lower and upper explosion limit / flammability limit Lower flammable limit: 1.4% by volume; Upper flammable limit: 7.6% by volume
    Flash point -51°C
    Auto-ignition temperature 420°C
    Decomposition temperature no data available
    pH no data available
    Kinematic viscosity 0.214 cP at 20°C
    Solubility less than 1 mg/mL at 22.78°C
    Partition coefficient n-octanol/water (log value) log Kow = 2.72 (est)
    Vapour pressure 11.17 psi ( 20 °C)
    Density and/or relative density 0.62g/mLat 25°C(lit.)
    Relative vapour density 2.6 (vs air)
    Particle characteristics no data available

    10.Stability and reactivity

    10.1 Reactivity

    no data available

    10.2 Chemical stability

    Stable under recommended storage conditions.

    10.3 Possibility of hazardous reactions

    A very dangerous fire hazard when exposed to heat, flame or oxidizers.The vapour is heavier than air and may travel along the ground; distant ignition possible. The vapour is heavier than air and may accumulate in lowered spaces causing a deficiency of oxygen.ISOPENTANE is a fire and explosion hazard when in contact with oxidizing agents. .

    10.4 Conditions to avoid

    no data available

    10.5 Incompatible materials

    ... Can react with oxidizing materials.

    10.6 Hazardous decomposition products

    When heated to decomposition it emits acrid smoke and irritating fumes.

    11.Toxicological information

    Acute toxicity

    • Oral: no data available
    • Inhalation: LC50 Mouse inhalation 1000 mg/L/1 hr (estimated)
    • Dermal: no data available

    Skin corrosion/irritation

    no data available

    Serious eye damage/irritation

    no data available

    Respiratory or skin sensitization

    no data available

    Germ cell mutagenicity

    no data available

    Carcinogenicity

    no data available

    Reproductive toxicity

    no data available

    STOT-single exposure

    no data available

    STOT-repeated exposure

    no data available

    Aspiration hazard

    no data available

    12.Ecological information

    12.1 Toxicity

    • Toxicity to fish: LC50; Species: Oncorhynchus mykiss (rainbow trout); Concentration: 3.1 mg/L/96 hr; Conditions: not specified
    • Toxicity to daphnia and other aquatic invertebrates: no data available
    • Toxicity to algae: no data available
    • Toxicity to microorganisms: no data available

    12.2 Persistence and degradability

    AEROBIC: Organisms isolated from groundwater contaminated by a gasoline spill were found to grow when inoculated with pure samples of isopentane; however, no biodegradation of isopentane was observed when a mixed culture of these organisms was inoculated with gasoline(1). A mixture containing isopentane, pentane, cyclopentane, 2,3-dimethylbutane, 2-methylpentane, 3-methylpentane, and cyclohexane, showed little degradation over the course of 30 days in a sediment/groundwater obtained from a contaminated jet fuel site in Oscoda, MI(2). Following a 6.1 day lag period, isopentane was completely degraded using an activated sludge over the course of a 20 day incubation period under aerobic conditions(3). The half-life of a mixture containing isopentane, pentane, and cyclopentane in seawater was 2.4 days(4).

    12.3 Bioaccumulative potential

    An estimated BCF of 70 was calculated in fish for isopentane(SRC), using a water solubility of 48 mg/L(1) and a regression-derived equation(2). According to a classification scheme(3), this BCF suggests the potential for bioconcentration in aquatic organisms is moderate(SRC).

    12.4 Mobility in soil

    The Koc of isopentane is estimated as 520(SRC), using a water solubility of 48 mg/L(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that isopentane is expected to have low mobility in soil(SRC).

    12.5 Other adverse effects

    no data available

    13.Disposal considerations

    13.1 Disposal methods

    Product

    The material can be disposed of by removal to a licensed chemical destruction plant or by controlled incineration with flue gas scrubbing. Do not contaminate water, foodstuffs, feed or seed by storage or disposal. Do not discharge to sewer systems.

    Contaminated packaging

    Containers can be triply rinsed (or equivalent) and offered for recycling or reconditioning. Alternatively, the packaging can be punctured to make it unusable for other purposes and then be disposed of in a sanitary landfill. Controlled incineration with flue gas scrubbing is possible for combustible packaging materials.

    14.Transport information

    14.1 UN Number

    ADR/RID: UN1265 IMDG: UN1265 IATA: UN1265

    14.2 UN Proper Shipping Name

    ADR/RID: PENTANES, liquid
    IMDG: PENTANES, liquid
    IATA: PENTANES, liquid

    14.3 Transport hazard class(es)

    ADR/RID: 3 IMDG: 3 IATA: 3

    14.4 Packing group, if applicable

    ADR/RID: I IMDG: I IATA: I

    14.5 Environmental hazards

    ADR/RID: yes IMDG: yes IATA: yes

    14.6 Special precautions for user

    no data available

    14.7 Transport in bulk according to Annex II of MARPOL 73/78 and the IBC Code

    no data available

    15.Regulatory information

    15.1 Safety, health and environmental regulations specific for the product in question

    Chemical name Common names and synonyms CAS number EC number
    isopentane isopentane 78-78-4 none
    European Inventory of Existing Commercial Chemical Substances (EINECS) Listed.
    EC Inventory Listed.
    United States Toxic Substances Control Act (TSCA) Inventory Listed.
    China Catalog of Hazardous chemicals 2015 Listed.
    New Zealand Inventory of Chemicals (NZIoC) Listed.
    Philippines Inventory of Chemicals and Chemical Substances (PICCS) Listed.
    Vietnam National Chemical Inventory Listed.
    Chinese Chemical Inventory of Existing Chemical Substances (China IECSC) Listed.

    16.Other information

    Information on revision

    Creation Date Aug 17, 2017
    Revision Date Aug 17, 2017

    Abbreviations and acronyms

    • CAS: Chemical Abstracts Service
    • ADR: European Agreement concerning the International Carriage of Dangerous Goods by Road
    • RID: Regulation concerning the International Carriage of Dangerous Goods by Rail
    • IMDG: International Maritime Dangerous Goods
    • IATA: International Air Transportation Association
    • TWA: Time Weighted Average
    • STEL: Short term exposure limit
    • LC50: Lethal Concentration 50%
    • LD50: Lethal Dose 50%
    • EC50: Effective Concentration 50%

    References

    • IPCS - The International Chemical Safety Cards (ICSC), website: http://www.ilo.org/dyn/icsc/showcard.home
    • HSDB - Hazardous Substances Data Bank, website: https://toxnet.nlm.nih.gov/newtoxnet/hsdb.htm
    • IARC - International Agency for Research on Cancer, website: http://www.iarc.fr/
    • eChemPortal - The Global Portal to Information on Chemical Substances by OECD, website: http://www.echemportal.org/echemportal/index?pageID=0&request_locale=en
    • CAMEO Chemicals, website: http://cameochemicals.noaa.gov/search/simple
    • ChemIDplus, website: http://chem.sis.nlm.nih.gov/chemidplus/chemidlite.jsp
    • ERG - Emergency Response Guidebook by U.S. Department of Transportation, website: http://www.phmsa.dot.gov/hazmat/library/erg
    • Germany GESTIS-database on hazard substance, website: http://www.dguv.de/ifa/gestis/gestis-stoffdatenbank/index-2.jsp
    • ECHA - European Chemicals Agency, website: https://echa.europa.eu/

    Disclaimer: The above information is believed to be correct but does not purport to be all inclusive and shall be used only as a guide. The information in this document is based on the present state of our knowledge and is applicable to the product with regard to appropriate safety precautions. It does not represent any guarantee of the properties of the product. We as supplier shall not be held liable for any damage resulting from handling or from contact with the above product.
    MSDS Expand
    1H NMR : 90 MHz in CDCl3Expand

    NMR Spectrum 1H NMR : 90 MHz in CDCl3

    Collapse

    C5 H12 0.04 ml : 0.5 ml CDCl3
    isopentane

    Assign. Shift(ppm)
    A 1.447
    B 1.20
    C 0.869
    D 0.865

    J(B,D)=7.3 HZ.
    J(A,C)=6.6 HZ.
    J(A,B)=6.6 HZ

    IR : liquid filmExpand
    Mass spectrum (electron ionization)Expand
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