[(Chloromethyl)sulfanyl]cyclohexane

Base Information

• Chemical Name: [(Chloromethyl)sulfanyl]cyclohexane
• CAS No.: 68483-71-6
• Molecular Formula: C7H13ClS
• Molecular Weight: 164.699
• DSSTox Substance ID: DTXSID00601773
• Wikidata: Q82498590
• Mol file: 68483-71-6.mol

Synonyms:[(chloromethyl)sulfanyl]cyclohexane;68483-71-6;chloromethylsulfanylcyclohexane;CHLOROMETHYL CYCLOHEXYL SULFIDE;chloromethylcyclohexylsulfide;SCHEMBL4818431;DTXSID00601773;UAWFPBICPLHLCY-UHFFFAOYSA-N;AKOS006221916;DB-243257

Chemical Property of [(Chloromethyl)sulfanyl]cyclohexane

Chemical Property:

• Vapor Pressure: 0.178mmHg at 25°C
• Refractive Index: 1.5210
• Boiling Point: 99-102oC 14mm
• Flash Point: 88.3oC
• PSA: 25.30000
• Density: 1.08g/cm3
• LogP: 3.24860
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 164.0426493
• Heavy Atom Count: 9
• Complexity: 69.3

Purity/Quality:

99% ^*data from raw suppliers

CHLOROMETHYL CYCLOHEXYL SULFIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)SCCl

Technology Process of [(Chloromethyl)sulfanyl]cyclohexane

There total 5 articles about [(Chloromethyl)sulfanyl]cyclohexane 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: 29.0%

dichloromethane (75-09-2) + 1,2-dicyclohexyl disulfide (2550-40-5) + c-hexyl trifluorothioacetate → cyclohexyl(trifluoromethyl)sulfane (6476-52-4) + chloromethyl cyclohexyl sulphide (68483-71-6) + dichloromethyl octyl sulfide + [(trifluoromethyl)disulfanyl]cyclohexane

Guidance literature:

at 40 ℃; for 1.5h; Irradiation;

DOI:10.1021/jo980649a

Reference yield:

Cyclohexanethiol (1569-69-3) → chloromethyl cyclohexyl sulphide (68483-71-6)

Guidance literature:

With hydrogenchloride; calcium chloride; paraformaldehyde;

Reference yield:

formaldehyd (50-00-0,30525-89-4,61233-19-0) → chloromethyl cyclohexyl sulphide (68483-71-6)

Guidance literature:

With hydrogenchloride; Cyclohexanethiol; unter Kuehlung;

upstream raw materials:

formaldehyd

diazomethane

cyclohexane sulphenyl chloride

Cyclohexanethiol

Downstream raw materials:

Cyclohexyl-trichlormethyl-sulfon

Cyclohexyl-<α,α-dichlor-methyl>-sulfon

chloromethyl cyclohexyl sulfone