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7318-67-4

7318-67-4 Structure

7318-67-4 Structure
IdentificationBack Directory
[Name]

CIS-1,4-HEXADIENE
[CAS]

7318-67-4
[Synonyms]

Nsc157585
(z)-4-hexadiene
CIS-1,4-HEXADIENE
(z)-1,4-hexadiene
1,4-cis-hexadiene
1,4-hexadiene-cis
1,cis-4-hexadiene
4-Hexadiene,(Z)-1
hexa-1,4cis-diene
(Z)-hexa-1,4-diene
(4Z)-1,4-Hexadiene
1,4-Hexadiene, (Z)-
1,4-Hexadiene, (4Z)-
(Z)-CH2=CHCH2CH=CHCH3
cis-1,4-Hexadiene >=99.0%
CIS-1,4-HEXADIENE ISO 9001:2015 REACH
[EINECS(EC#)]

230-783-6
[Molecular Formula]

C6H10
[MDL Number]

MFCD00066517
[MOL File]

7318-67-4.mol
[Molecular Weight]

82.14
Chemical PropertiesBack Directory
[Melting point ]

-94.9°C (estimate)
[Boiling point ]

65-66 °C (lit.)
[density ]

0.707 g/mL at 20 °C (lit.)
[refractive index ]

n20/D 1.415
[Fp ]

-46 °C
[BRN ]

1839519
[InChI]

1S/C6H10/c1-3-5-6-4-2/h3-4,6H,1,5H2,2H3/b6-4-
[InChIKey]

PRBHEGAFLDMLAL-XQRVVYSFSA-N
[SMILES]

C\C=C/CC=C
[LogP]

2.910 (est)
Safety DataBack Directory
[Hazard Codes ]

F,Xn
[Risk Statements ]

11-65
[Safety Statements ]

16-62
[RIDADR ]

UN 2458 3/PG 2
[WGK Germany ]

3
[RTECS ]

MM1997000
[Storage Class]

3 - Flammable liquids
[Hazard Classifications]

Acute Tox. 3 Oral
Asp. Tox. 1
Flam. Liq. 2
Hazard InformationBack Directory
[Uses]

cis-1,4-Hexadiene can be synthesized from the cobalt-catalyzed reaction between butadiene and ethylene. The reaction of this hydrocarbon with Fe(CO)5 affords the trans-1,3-hexadiene-iron tricarbonyl complex (I), plus a small amount of the trans,trans-2,4-hexadiene complex(II). Mechanism of the conversion of cis-1,4-hexadiene to trans-2-methyl-1,3-pentadiene, via rearrangement in the presence of a nickel catalyst has been investigated.
[General Description]

cis-1,4-Hexadiene can be synthesized from the cobalt-catalyzed reaction between butadiene and ethylene. The reaction of this hydrocarbon with Fe(CO)5 affords the trans-1,3-hexadiene-iron tricarbonyl complex (I), plus a small amount of the trans,trans-2,4-hexadiene complex(II). Mechanism of the conversion of cis-1,4-hexadiene to trans-2-methyl-1,3-pentadiene, via rearrangement in the presence of a nickel catalyst has been investigated.
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