52435
cis-1,4-Hexadiene
≥99.0%
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About This Item
Empirical Formula (Hill Notation):
C6H10
CAS Number:
Molecular Weight:
82.14
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
230-783-6
Beilstein/REAXYS Number:
1839519
MDL number:
Assay:
≥99.0%
Quality Segment
assay
≥99.0%
refractive index
n
bp
65-66 °C (lit.)
density
0.707 g/mL at 20 °C (lit.)
functional group
allyl
SMILES string
C\C=C/CC=C
InChI
1S/C6H10/c1-3-5-6-4-2/h3-4,6H,1,5H2,2H3/b6-4-
InChI key
PRBHEGAFLDMLAL-XQRVVYSFSA-N
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.
Signal Word
Danger
Hazard Codes
Precautionary Statements
Hazard Classifications
Acute Tox. 3 Oral - Asp. Tox. 1 - Flam. Liq. 2
Storage Class
3 - Flammable liquids
WGK
WGK 3
Flash Point (°F)
-50.8 °F - closed cup
Flash Point (°C)
-46 °C - closed cup
PPE (personal protective equipment)
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
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