1-Chloro-5-methylheptane

Base Information

Chemical Name:1-Chloro-5-methylheptane
CAS No.:2350-24-5
Deprecated CAS:128524-37-8
Molecular Formula:C8H17 Cl
Molecular Weight:148.676
Hs Code.:2903199000
DSSTox Substance ID:DTXSID00883830
Nikkaji Number:J36.975F
Mol file:2350-24-5.mol

Synonyms:1-Chloro-5-methylheptane;2350-24-5;HEPTANE, 1-CHLORO-5-METHYL-;2-Ethylhexyl-6-chloride;1-CHLORO-5-METHYL-HEPTANE;BRN 1814379;SCHEMBL9066205;DTXSID00883830;AKOS006277667;LS-74300

Suppliers and Price of 1-Chloro-5-methylheptane

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 6 raw suppliers

Chemical Property of 1-Chloro-5-methylheptane

Chemical Property:

Vapor Pressure:1.69mmHg at 25°C
Melting Point:-41.9°C (estimate)
Refractive Index:1.4181 (estimate)
Boiling Point:173.4°Cat760mmHg
Flash Point:52.5°C
PSA：0.00000
Density:0.862g/cm³
LogP:3.44160
XLogP3:3.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:0
Rotatable Bond Count:5
Exact Mass:148.1018782
Heavy Atom Count:9
Complexity:52.5

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC(C)CCCCCl

Technology Process of 1-Chloro-5-methylheptane

There total 4 articles about 1-Chloro-5-methylheptane 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: 82.0%

: 632-02-0
3-chloropropyl p-toluenesulfonate

: 10422-35-2,99032-67-4,534-00-9,5973-11-5
1-bromo-2-methyl-butane

: 2350-24-5,128524-37-8
5-methylheptyl chloride

Guidance literature:: 1-bromo-2-methyl-butane; With magnesium; In tetrahydrofuran; Inert atmosphere;

3-chloropropyl p-toluenesulfonate; With dilithium tetrachlorocuprate; In tetrahydrofuran; at -70 - 20 ℃; Inert atmosphere;
DOI:10.1271/bbb.90805

Reference yield:

: 137-32-6
(+/-)-2-methyl-1-butanol

: 2350-24-5,128524-37-8
5-methylheptyl chloride

Guidance literature:: Multi-step reaction with 3 steps

1.1: pyridine / 3 h / 0 - 5 °C

2.1: lithium bromide / N,N-dimethyl-formamide / 1 h / 60 °C

3.1: magnesium / tetrahydrofuran / Inert atmosphere

3.2: -70 - 20 °C / Inert atmosphere

With pyridine; magnesium; lithium bromide; In tetrahydrofuran; N,N-dimethyl-formamide;
DOI:10.1271/bbb.90805

Reference yield:

: 63526-71-6
p-toluenesulfonic acid 2-methylbutyl ester

: 2350-24-5,128524-37-8
5-methylheptyl chloride

Guidance literature:: Multi-step reaction with 2 steps

1.1: lithium bromide / N,N-dimethyl-formamide / 1 h / 60 °C

2.1: magnesium / tetrahydrofuran / Inert atmosphere

2.2: -70 - 20 °C / Inert atmosphere

With magnesium; lithium bromide; In tetrahydrofuran; N,N-dimethyl-formamide;
DOI:10.1271/bbb.90805