BENZENE, 1-CHLORO-4-CYCLOHEXYL-

Base Information

• Chemical Name: BENZENE, 1-CHLORO-4-CYCLOHEXYL-
• CAS No.: 829-32-3
• Molecular Formula: C12H15Cl
• Molecular Weight: 194.704
• Hs Code.: 2903999090
• Mol file: 829-32-3.mol

Synonyms:1-Chlor-4-cyclohexyl-benzol;p-cyclohexylphenyl chloride;<4-Chlor-phenyl>-cyclohexan;1-chloro-4-cyclohexyl-benzene;

Chemical Property of BENZENE, 1-CHLORO-4-CYCLOHEXYL-

Chemical Property:

• Vapor Pressure: 0.00957mmHg at 25°C
• Boiling Point: 273.5°Cat760mmHg
• Flash Point: 110.6°C
• PSA: 0.00000
• Density: 1.066g/cm³
• LogP: 4.38770
• Storage Temp.: 2-8°C

Purity/Quality:

99% ^*data from raw suppliers

1-Chloro-4-cyclohexylbenzene 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of BENZENE, 1-CHLORO-4-CYCLOHEXYL-

There total 39 articles about BENZENE, 1-CHLORO-4-CYCLOHEXYL- 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: 95.0%

C21H18ClNO4 → 1-chloro-4-cyclohexylbenzene (829-32-3)

Guidance literature:

With diethyl 2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate; In N,N-dimethyl acetamide; at 25 ℃; for 24h; Inert atmosphere; Schlenk technique; Irradiation; Green chemistry;

DOI:10.1002/adsc.201900803

Reference yield: 74.0%

4-chlorophenyl trifluoromethanesulfonate (29540-84-9) + cyclohexylzinc chloride (256390-55-3) → 1-chloro-4-cyclohexylbenzene (829-32-3)

Guidance literature:

With di-μ-iodobis(tri-t-butylphosphino)dipalladium(l); In 1-methyl-pyrrolidin-2-one; at 20 ℃; for 0.166667h; chemoselective reaction;

DOI:10.1002/anie.201808386

Reference yield: 71.0%

trans-4-(p-chlorophenyl)cyclohexane carboxylic acid (95233-37-7,1346600-43-8) → 1-chloro-4-cyclohexylbenzene (829-32-3)

Guidance literature:

With 2,4,6-trimethyl-pyridine; ammonium peroxydisulfate; In dimethylsulfoxide-d6; at 60 ℃; for 2h; Sealed tube; Inert atmosphere;

DOI:10.1021/acs.orglett.1c04079

upstream raw materials:

p-cyclohexylaniline

cyclohexyl chloride

chlorobenzene

cyclohexene

Downstream raw materials:

4-chloro-1-cyclohexyl-2-nitro-benzene

1-chloro-4-cyclohexyl-2,5-dinitro-benzene

para-chlorobenzoic acid

5-Chloro-2-cyclohexylaniline

Refernces

• 1、 Cao, Yuhui,Che, Jinteng,Chen, Han,Chen, Si-Cong,Fang, Xianhe,Guo, Yinliang,Guo, Zhixian,Kong, Lingran,Li, Chen,Lu, Jia-Tian,Luo, Tuoping,Zhang, Nan,Zhu, Qi. "Dealkenylative Ni-Catalyzed Cross-Coupling Enabled by Tetrazine and Photoexcitation". supporting information. p. 14046 - 14052. Retrieved 2021/09/13.
• 2、 Keaveney, Sinead T.,Kundu, Gourab,Schoenebeck, Franziska. "Modular Functionalization of Arenes in a Triply Selective Sequence: Rapid C(sp2) and C(sp3) Coupling of C?Br, C?OTf, and C?Cl Bonds Enabled by a Single Palladium(I) Dimer". supporting information. p. 12573 - 12577. Retrieved 2018/09/18.