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ChemicalBook--->CAS DataBase List--->592-41-6

592-41-6

592-41-6 Structure

592-41-6 Structure
IdentificationMore
[Name]

1-Hexene
[CAS]

592-41-6
[Synonyms]

1-HEXENE
Butylethene
BUTYLETHYLENE
HEX-1-ENE
l-Hexene
1-C6H12
1-n-Hexene
dialene6
Hexen
Hexene
Hexene-1
Hexylene
Neodene 6
1-HEXENE, 97% (POLY-COATED BOTTLES)
1-HEXENE 99+%
1-HEXENE, STANDARD FOR GC
1-Hexene,98+%
1-Hexen
1-Hexene [Standard Material]
N-HEXENE
[EINECS(EC#)]

209-753-1
[Molecular Formula]

C6H12
[MDL Number]

MFCD00009505
[Molecular Weight]

84.16
[MOL File]

592-41-6.mol
Chemical PropertiesBack Directory
[Appearance]

colourless liquid
[Melting point ]

-140 °C
[Boiling point ]

60-66 °C (lit.)
[density ]

0.678 g/mL at 25 °C(lit.)
[vapor density ]

3 (vs air)
[vapor pressure ]

155 mm Hg ( 21.1 °C)
[refractive index ]

n20/D 1.388(lit.)
[Fp ]

−19 °F
[storage temp. ]

Refrigerator
[solubility ]

Soluble in alcohol, benzene, chloroform, ether, petroleum (Weast, 1986), and many other hydrocarbons including alkenes amd alkanes.
[form ]

Liquid
[pka]

>14 (Schwarzenbach et al., 1993)
[color ]

Clear colorless
[Specific Gravity]

0.673
[Odor]

Mild, pleasant.
[Stability:]

Stable. Highly flammable-note low flash point. Incompatible with strong oxidizing agents, strong acids, combustible material.
[Odor Threshold]

0.14ppm
[Water Solubility ]

0.005 g/100 mL
[BRN ]

1209240
[Henry's Law Constant]

(atm?m3/mol): 0.435 at 25 °C (Hine and Mookerjee, 1975)
[Dielectric constant]

2.1(Ambient)
[Exposure limits]

ACGIH TLV: TWA 30 ppm (adopted).
[InChIKey]

LIKMAJRDDDTEIG-UHFFFAOYSA-N
[LogP]

3.87 at 20℃
[CAS DataBase Reference]

592-41-6(CAS DataBase Reference)
[NIST Chemistry Reference]

1-Hexene(592-41-6)
[EPA Substance Registry System]

592-41-6(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

F,Xn,N
[Risk Statements ]

R11:Highly Flammable.
R65:Harmful: May cause lung damage if swallowed.
R67:Vapors may cause drowsiness and dizziness.
R51/53:Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment .
[Safety Statements ]

S9:Keep container in a well-ventilated place .
S16:Keep away from sources of ignition-No smoking .
S23:Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer) .
S29:Do not empty into drains .
S62:If swallowed, do not induce vomiting: seek medical advice immediately and show this container or label .
S57:Use appropriate container to avoid environmental contamination .
S33:Take precautionary measures against static discharges .
[RIDADR ]

UN 2370 3/PG 2
[WGK Germany ]

1
[RTECS ]

MP6670000
[Autoignition Temperature]

487 °F
[TSCA ]

Yes
[HazardClass ]

3
[PackingGroup ]

II
[HS Code ]

29012980
[Hazardous Substances Data]

592-41-6(Hazardous Substances Data)
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Barium sulfate-->Barium hydroxide-->1,5-HEXADIENE-->5-Hexen-1-ol
[Preparation Products]

Permethrin-->METHYL 3-(2,2-DICHLOROVINYL)-2,2-DIMETHYL-(1-CYCLOPROPANE)CARBOXYLATE-->Sorbic acid-->Cyfluthrin-->ethyl 3-(2,2-dichlorovinyl)-2,2-dimethyl-1-cyclopropanecarboxylate-->Heptanoic acid-->β-Carotene-->2,2-DIMETHYL-3-(2-METHYLPROP-1-ENYL)CYCLOPROPANECARBOXYLIC ACID-->1,2-Epoxyhexane-->3-[2-chloro-2-(4-chlorophenyl)ethenyl]-2,2-dimethyl cyclopropane carboxylic acid-->CINITAPRIDE HYDROGEN TARTRATE-->ethyl 4,6,6-trichloro-3,3-dimethyl-hex-5-enoate-->4-HEXEN-3-ONE-->TRANS,CIS-2,6-NONADIEN-1-OL-->2-hexanethiol-->CIS-2-HEXENE
Hazard InformationBack Directory
[General Description]

A clear colorless liquid with a petroleum like odor. Flash point-9°F. Less dense than water and insoluble in water. Vapors heavier than air. Used as a solvent, paint thinner, and chemical reaction medium.
[Reactivity Profile]

1--HEXENE may react vigorously with strong oxidizing agents. May react exothermically with reducing agents to release hydrogen gas.
[Air & Water Reactions]

Highly flammable. Insoluble in water.
[Hazard]

Irritant. Highly flammable, dangerous fire risk.
[Health Hazard]

Inhalation may cause giddiness or incoordination similar to that from gasoline vapor. Prolonged exposure to high concentrations may induce loss of consciousness or death.
[Description]

Hexene is a colorless liquid. Molecu larweight= 84.14;Boiling point= 63-65℃;Freezing/Melting point=一140℃; Flash point= - 7℃; Autoignitiontemperature = 253℃. Explosive Limits:LEL= 1.2%;UEL= 6.9%. Hazard Identification (based on NFPA-704 MRating System): Health 1, Flammability 3, Reactivity 0.Insoluble in water.
[Chemical Properties]

1-Hexene, C6H12, is a colorless liquid, which is highly volatile and flammable. Hexene is a component of refinery gas and coffee aroma.
[Chemical Properties]

colourless liquid
[Physical properties]

Clear, colorless, flammable liquid with a characteristic, sweetish odor similar to hexane or 1-pentene. An odor threshold concentration of 140 ppbv was reported by Nagata and Takeuchi (1990).
[Uses]

[Definition]

ChEBI: An alkene that is hexane carrying a double bond at position 1.
[Chemical Reactivity]

Reactivity with Water No reaction; Reactivity with Common Materials: No reactions; Stability During Transport: Stable; Neutralizing Agents for Acids and Caustics: Not pertinent; Polymerization: Not pertinent; Inhibitor of Polymerization: Not pertinent.
[Potential Exposure]

Those involved in its use in organicsynthesis. .Used in fuels,and to make flavors,perfumes,dyes, and plastic resins.
[First aid]

If this chemical gets into the eyes, remove anycontact lenses at once and irrigate immediately for at least15 min, occasionally lifting upper and lower lids. Seek med-ical attention immediately. If this chemical contacts theskin, remove contaminated clothing and wash immediatelywith soap and water. Seek medical attention immediately. Ifthis chemical has been inhaled,remove from exposure,begin rescue breathing (using universal precautions, includ-ing resuscitation mask) if breathing has stopped and CPR ifheart action has stopped. Transfer promptly to a medicalfacility. When this chemical has been swallowed, get medi-cal attention. Give large quantities of water and inducevomiting. Do not make an unconscious person vomit.
[Source]

California Phase II reformulated gasoline contained 1-hexene at a concentration of 770 mg/kg. Gas-phase tailpipe emission rates from gasoline-powered automobiles with and without catalytic converters were 430 and 18,400 μg/km, respectively (Schauer et al., 2002).
According to Chevron Phillips Company’s (2005) product literature, the maximum concentration present in 99.7% tert-butyl mercaptan is 0.05 wt %.
[Environmental Fate]

Biological. Biooxidation of 1-hexene may occur yielding 5-hexen-1-ol, which may oxidize to give 5-hexenoic acid (Dugan, 1972). Washed cell suspensions of bacteria belonging to the genera Mycobacterium, Nocardia, Xanthobacter, and Pseudomonas and growing on selected alkenes metabolized 1-hexene to 1,2-epoxyhexane (Van Ginkel et al., 1987).
Photolytic. The following rate constants were reported for the reaction of 1-hexene and OH radicals in the atmosphere: 1.9 x 10-12 cm3/molecule?sec at 300 K (Hendry and Kenley, 1979); 3.75 x 10-11 cm3/molecule?sec at 295 K (Atkinson and Carter, 1984); 3.18 x 10-11 cm3/molecule?sec (Atkinson, 1990). The following rate constants were reported for the reaction of 1-hexene and ozone in the atmosphere: 1.10 x 10-17 cm3/molecule?sec (Bufalini and Altshuller, 1985); 9.0 x 10-17 cm3/molecule?sec (Cadle and Schadt, 1952); 1.40 x 10-17 cm3/molecule?sec (Cox and Penkett, 1972); 1.08 x 10-17 cm3/molecule?sec at 294 K (Adeniji et al., 1981).
Chemical/Physical. Complete combustion in air yields carbon dioxide and water.
1-Hexene is not expected to hydroxyze in water.
[storage]

Color Code- -Red: Flammability Hazard: Store ina flammable liquid storage area or approved cabinet awayfrom ignition sources and corrosive and reactive materials.Prior to working with hexene you should be trained on itsproper handling and storage. Before entering confined spacewhere hexene may be present, check to make sure that anexplosive concentration does not exist. Store in tightlyclosed containers in a cool, well-ventilated area away fromoxidizers and strong acids. Metal containers involving thetransfer of this chemical should be grounded and bonded.Where possible, automatically pump liquid from drums orother storage containers to process containers. Drums mustbe equipped with self-closing valves, pressure vacuumbungs, and flame arresters. Use only nonsparking tools andequipment, especially when opening and closing containersof this chemical. Sources of ignition, such as smoking andopen flames, are prohibited where this chemical is used,handled, or stored in a manner that could create a potentialfire or explosion hazard. Wherever this chemical is used,handled, manufactured, or stored, use explosion-proof elec-trical equipment and fittings.
[Shipping]

This compound requiresa shipping label of“FL .AMMABLE LIQUID." It falls in Hazard Class 3;andPacking Group II.
[Purification Methods]

Purify it by stirring over Na/K alloy for at least 6hours, then fractionally distil it from sodium under nitrogen. [Beilstein 1 IV 828.]
[Incompatibilities]

Formsexplosivemixturewithair.Violent reaction with oxidizers, strong acids.
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

1-Hexene(592-41-6).msds
Spectrum DetailBack Directory
[Spectrum Detail]

1-Hexene(592-41-6)MS
1-Hexene(592-41-6)1HNMR
1-Hexene(592-41-6)13CNMR
1-Hexene(592-41-6)IR1
1-Hexene(592-41-6)IR2
1-Hexene(592-41-6)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

1-Hexene, 97%(592-41-6)
[Alfa Aesar]

1-Hexene, 98%(592-41-6)
[Sigma Aldrich]

592-41-6(sigmaaldrich)
[TCI AMERICA]

1-Hexene,>95.0%(GC)(592-41-6)
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