1-(o-Chlorobenzyl)-2-oxocyclohexanepropionic acid

Base Information

Chemical Name:1-(o-Chlorobenzyl)-2-oxocyclohexanepropionic acid
CAS No.:791-45-7
Molecular Formula:C₁₆H₁₉ClO₃
Molecular Weight:294.778
Hs Code.:
DSSTox Substance ID:DTXSID801000263
Nikkaji Number:J75.424B
Mol file:791-45-7.mol

Synonyms:791-45-7;BRN 2750333;1-(o-Chlorobenzyl)-2-oxocyclohexanepropionic acid;Cyclohexanepropionic acid, 1-(o-chlorobenzyl)-2-oxo-;Acido 2-(o-chlorobenzil)cicloessanon-2-beta-propionico [Italian];Acido 2-(o-chlorobenzil)cicloessanon-2-beta-propionico;DTXSID801000263;3-{1-[(2-CHLOROPHENYL)METHYL]-2-OXOCYCLOHEXYL}PROPANOIC ACID

Suppliers and Price of 1-(o-Chlorobenzyl)-2-oxocyclohexanepropionic acid

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 5 raw suppliers

Chemical Property of 1-(o-Chlorobenzyl)-2-oxocyclohexanepropionic acid

Chemical Property:

Vapor Pressure:1.95E-09mmHg at 25°C
Boiling Point:464.8°Cat760mmHg
Flash Point:234.9°C
PSA：54.37000
Density:1.226g/cm³
LogP:3.87680
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:294.1022722
Heavy Atom Count:20
Complexity:369

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CCC(C(=O)C1)(CCC(=O)O)CC2=CC=CC=C2Cl

Technology Process of 1-(o-Chlorobenzyl)-2-oxocyclohexanepropionic acid

There total 5 articles about 1-(o-Chlorobenzyl)-2-oxocyclohexanepropionic acid 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:

: 2866-66-2
2-<2-Chlor-benzyl>-2-<2-cyan-aethyl>-cyclohexanon

: 791-45-7
3-<1-(2-Chlor-benzyl)-2-oxo-cyclohexyl>-propionsaeure

Guidance literature:: With hydrogenchloride; In acetic acid; Heating;

Reference yield:

: 1125-99-1
1-(1-Cyclohexen-1-yl)pyrrolidine

: 791-45-7
3-<1-(2-Chlor-benzyl)-2-oxo-cyclohexyl>-propionsaeure

Guidance literature:: Multi-step reaction with 3 steps

1: (i) , (ii) aq. HCl

2: 2NMe₃>OH / methanol

3: aq. HCl / acetic acid / Heating

With hydrogenchloride; N-benzyl-trimethylammonium hydroxide; In methanol; acetic acid;

Reference yield:

: 2702-77-4
2-<2-Chlor-benzyl>-cyclohexanon

: 791-45-7
3-<1-(2-Chlor-benzyl)-2-oxo-cyclohexyl>-propionsaeure

Guidance literature:: Multi-step reaction with 2 steps

1: 2NMe₃>OH / methanol

2: aq. HCl / acetic acid / Heating

With hydrogenchloride; N-benzyl-trimethylammonium hydroxide; In methanol; acetic acid;