1-Chlorohexane

Base Information

Chemical Name:1-Chlorohexane
CAS No.:544-10-5
Deprecated CAS:61383-30-0
Molecular Formula:C6H13Cl
Molecular Weight:120.622
Hs Code.:29031980
European Community (EC) Number:208-859-5
UN Number:1993
UNII:R5L7I6O9NW
DSSTox Substance ID:DTXSID1060265
Nikkaji Number:J2.647F
Wikidata:Q15726107
ChEMBL ID:CHEMBL156095
Mol file:544-10-5.mol

Synonyms:1-chlorohexane

Suppliers and Price of 1-Chlorohexane

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 22 raw suppliers

Chemical Property of 1-Chlorohexane

Chemical Property:

Appearance/Colour:colorless liquid, aromatic odor
Vapor Pressure:10.2mmHg at 25°C
Melting Point:-94 °C(lit.)
Refractive Index:n20/D 1.419(lit.)
Boiling Point:133.935 °C at 760 mmHg
Flash Point:26.667 °C
PSA：0.00000
Density:0.868 g/cm³
LogP:2.80550
XLogP3:3.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:0
Rotatable Bond Count:4
Exact Mass:120.0705781
Heavy Atom Count:7
Complexity:27.4
Transport DOT Label:Combustible Liquid

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s): Xi,N
Hazard Codes: Xi:Irritant;
Statements: R10:; R20/21:; R37:;
Safety Statements: S16:; S23:;

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Chemical Classes:Other Classes -> Halogenated Aliphatics, Saturated
Canonical SMILES:CCCCCCCl

Technology Process of 1-Chlorohexane

There total 57 articles about 1-Chlorohexane 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: 99.0%

: 111-27-3
hexan-1-ol

: 544-10-5
1-Chlorohexane

Guidance literature:: With priphenylchlorophosphonium phosphorodichloridate; at 20 ℃;
DOI:10.1023/A:1013264726682

Reference yield: 82.0%

: 4747-07-3
hexyl methyl ether

: 544-10-5
1-Chlorohexane

: 101-41-7
benzeneacetic acid methyl ester

Guidance literature:: With phenylacetyl chloride; zinc; In Petroleum ether; at 28 ℃; for 4h; Yields of byproduct given;
DOI:10.1021/jo00108a048