Cyclohexane, 1-bromo-2-chloro-, trans-

Base Information

• Chemical Name: Cyclohexane, 1-bromo-2-chloro-, trans-
• CAS No.: 13898-96-9
• Molecular Formula: C6H10BrCl
• Molecular Weight: 197.502
• Nikkaji Number: J483.324D
• Mol file: 13898-96-9.mol

Synonyms:13898-96-9;Cyclohexane, 1-bromo-2-chloro-, trans-;trans-2-Chlorocyclohexyl bromide;trans-2-Chloro-1-bromocyclohexane;1,2-trans-Chlorbromcyclohexan;(1R,2R)-1-Brom-2-chlorcyclohexan

Chemical Property of Cyclohexane, 1-bromo-2-chloro-, trans-

Chemical Property:

• Vapor Pressure: 0.249mmHg at 25°C
• Boiling Point: 212.7°C at 760 mmHg
• Flash Point: 96.4°C
• Density: 1.45g/cm³
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 195.96544
• Heavy Atom Count: 8
• Complexity: 74.9

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(C(C1)Cl)Br
• Isomeric SMILES: C1CC[C@H]([C@@H](C1)Cl)Br

Technology Process of Cyclohexane, 1-bromo-2-chloro-, trans-

There total 11 articles about Cyclohexane, 1-bromo-2-chloro-, trans- 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: 92.0%

cyclohexene (110-83-8) → (+-)-trans-1-bromo-2-chloro-cyclohexane (13898-96-9)

Guidance literature:

With N-chlorodiethylamine; phosphorus(V) oxybromide; In dichloromethane; at -70 ℃; for 1h;

DOI:10.1080/10426509808035682

Reference yield: 36.0%

cyclohexene (110-83-8) → (+-)-trans-1-bromo-2-chloro-cyclohexane (13898-96-9) + trans-1,2-dibromocyclohexane (7429-37-0)

Guidance literature:

With sodium hypochlorite; tetra(n-butyl)ammonium hydrogensulfate; sodium bromide; In benzene; for 0.0833333h; Ambient temperature;

DOI:10.1021/jo00042a044

Reference yield: 18.0%

trans-2-chlorocyclohexyl N,N-diethylamidosulfite → (+-)-trans-1-bromo-2-chloro-cyclohexane (13898-96-9)

Guidance literature:

With tetrabutylammomium bromide; In dichloromethane; for 24h; Heating;

upstream raw materials:

cyclohexene

trans-2-chlorocyclohexanol

2-bromocyclocyclohexanol

cyclohexane

Downstream raw materials:

2-ethoxycyclohex-1-ene

1-bromocyclohex-1-ene

1-chlorocyclohexene

cyclohexene