CIS-1,4-HEXADIENE

Base Information

• Chemical Name: CIS-1,4-HEXADIENE
• CAS No.: 7318-67-4
• Molecular Formula: C6H10
• Molecular Weight: 82.1454
• European Community (EC) Number: 230-783-6
• UNII: FUZ7TAA620
• DSSTox Substance ID: DTXSID301015940
• Nikkaji Number: J212.310J
• Wikidata: Q27278213
• Mol file: 7318-67-4.mol

Synonyms:1,4-Hexadiene,(Z)- (8CI); (Z)-1,4-Hexadiene; 1,4(Z)-Hexadiene; 1,4-cis-Hexadiene;cis-1,4-Hexadiene

Chemical Property of CIS-1,4-HEXADIENE

Chemical Property:

• Melting Point: -94.9°C (estimate)
• Refractive Index: n20/D 1.415
• Boiling Point: 65-66 °C(lit.)
• Flash Point: -46 °C
• PSA: 0.00000
• Density: 0.707 g/mL at 20 °C(lit.)
• LogP: 2.13860
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 82.078250319
• Heavy Atom Count: 6
• Complexity: 51.1

Purity/Quality:

98%,99%, ^*data from raw suppliers

cis-1,4-Hexadiene ≥99.0% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): 1839519
• Hazard Codes: F,Xn
• Statements: 11-65
• Safety Statements: 16-62

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC=CCC=C
• Isomeric SMILES: C/C=C\CC=C

Technology Process of CIS-1,4-HEXADIENE

There total 6 articles about CIS-1,4-HEXADIENE which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

1,5-Hexadien (592-42-7) → (2E,4E)-hexa-2,4-diene (5194-51-4) + (E,Z)-2,4-hexadiene (5194-50-3) + hexa-1,3-diene (592-48-3) + cis-1,4-hexadiene (7318-67-4) + (E)-1,4-hexadiene (7319-00-8) + cis,cis-2,4-Hexadien (6108-61-8)

Guidance literature:

aluminum oxide; potassium oxide; at 450 ℃; Product distribution;

DOI:10.1007/BF00961616

Reference yield:

exo-2-methylbicyclo<3.1.0>hexan-3-one (79345-10-1,79345-11-2,101758-62-7,101758-63-8) → cis-1,4-hexadiene (7318-67-4) + (E)-1,4-hexadiene (7319-00-8)

Guidance literature:

In various solvent(s); at 20 ℃; Product distribution; Irradiation; other temperatures;

DOI:10.1021/ja00414a046

Reference yield:

endo-2-methylbicyclo<3.1.0>hexan-3-one (79345-10-1,79345-11-2,101758-62-7,101758-63-8) → cis-1,4-hexadiene (7318-67-4) + (E)-1,4-hexadiene (7319-00-8)

Guidance literature:

In various solvent(s); at 20 ℃; Product distribution; Irradiation; other temperatures;

DOI:10.1021/ja00414a046

upstream raw materials:

1,5-Hexadien

exo-2-methylbicyclo<3.1.0>hexan-3-one

endo-2-methylbicyclo<3.1.0>hexan-3-one

ethene

Downstream raw materials:

(Z)-5-methylenehept-2-ene

di(n-1-hexenyl)aluminum chloride

hexa-2,4-diene

1-hexene