5-Chlorohex-1-ene

Base Information

• Chemical Name: 5-Chlorohex-1-ene
• CAS No.: 927-54-8
• Molecular Formula: C6H11Cl
• Molecular Weight: 118.606
• DSSTox Substance ID: DTXSID00559826
• Nikkaji Number: J841.496C
• Mol file: 927-54-8.mol

Synonyms:5-Chlorohex-1-ene;927-54-8;5-chloro-1-hexene;5-chloro-hex-1-ene;1-Hexene, 5-chloro-;SCHEMBL6595766;DTXSID00559826;XPCQFYOMEFDDOT-UHFFFAOYSA-N;AKOS030255434

Chemical Property of 5-Chlorohex-1-ene

Chemical Property:

• Vapor Pressure: 17.584mmHg at 25°C
• Refractive Index: 1.4305
• Boiling Point: 121.346oC at 760 mmHg
• Flash Point: 20.115oC
• PSA: 0.00000
• Density: 0.882g/cm3
• LogP: 2.57990
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 3
• Exact Mass: 118.0549280
• Heavy Atom Count: 7
• Complexity: 50.1

Purity/Quality:

95%+ or 98%+ ^*data from raw suppliers

5-Chloro-1-hexene ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CCC=C)Cl

Technology Process of 5-Chlorohex-1-ene

There total 2 articles about 5-Chlorohex-1-ene 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:

tetrachloromethane (56-23-5) + propene (187737-37-7,13987-01-4,15220-87-8,9003-07-0,676-63-1,25085-53-4) → 5-chlorohex-1-ene (927-54-8) + 1,1,1,5-tetrachloro-3-methylhexane (13275-22-4) + 1,5-Hexadien (592-42-7) + 1,1,1-trichloro-butane (13279-85-1) + 1,1,1,3-tetrachlorobutane (13275-19-9) + 1,1,1-trichloro-3-methyl-hexane (13275-20-2)

Guidance literature:

With di-tert-butyl peroxide; at 140 ℃; for 1h; Product distribution; Mechanism; chain termination in the telomerization of title compound;

DOI:10.1007/BF00957255

Reference yield:

hydrogenchloride (7647-01-0,15364-23-5) + 1,5-Hexadien (592-42-7) → 2,5-dimethyltetrahydrofuran (1003-38-9) + 5-chlorohex-1-ene (927-54-8) + meso-2,5-dichlorohexane (41761-11-9)

Guidance literature:

DOI:10.1021/ja01367a033

Reference yield:

5-chlorohex-1-ene (927-54-8) → 1-hexene (592-41-6,25067-06-5)

Guidance literature:

With 2,2'-azobis(isobutyronitrile); tri-n-butyl-tin hydride; at 90 ℃; for 16h;

DOI:10.1016/0022-328X(89)85216-7

upstream raw materials:

tetrachloromethane

propene

hydrogenchloride

1,5-Hexadien

Downstream raw materials:

formic acid

1-bromo-5-chloro-hexane

1-hexene

p-Nitrobenzolsulfonsaeure-5-chlor-1-hexylester