1,2-Propanediol, 3-chloro-2-(2,4-difluorophenyl)-, (2R)-

Base Information

Chemical Name:1,2-Propanediol, 3-chloro-2-(2,4-difluorophenyl)-, (2R)-
CAS No.:506439-68-5
Molecular Formula:C9H9ClF2O2
Molecular Weight:222.619
Hs Code.:
DSSTox Substance ID:DTXSID00459453
Nikkaji Number:J1.847.975C
Wikidata:Q82283222

Synonyms:506439-68-5;1,2-Propanediol, 3-chloro-2-(2,4-difluorophenyl)-, (2R)-;DTXSID00459453;(R)-3-Chloro-2-(2,4-difluorophenyl)-1,2-propanediol

Suppliers and Price of 1,2-Propanediol, 3-chloro-2-(2,4-difluorophenyl)-, (2R)-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
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Total 0 raw suppliers

Chemical Property of 1,2-Propanediol, 3-chloro-2-(2,4-difluorophenyl)-, (2R)-

Chemical Property:

XLogP3:1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:222.0259135
Heavy Atom Count:14
Complexity:194

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=C(C=C1F)F)C(CO)(CCl)O
Isomeric SMILES:C1=CC(=C(C=C1F)F)[C@@](CO)(CCl)O

Technology Process of 1,2-Propanediol, 3-chloro-2-(2,4-difluorophenyl)-, (2R)-

There total 4 articles about 1,2-Propanediol, 3-chloro-2-(2,4-difluorophenyl)-, (2R)- 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: 41.5%

: 164347-62-0
1,2-epoxy-3-chloro-2-(2,4-difluorophenyl)-propane

: (S)-1-chloro-2-(2,4-difluorophenyl)-2,3-epoxypropane

: 506439-68-5
(R)-3-chloro-2-(2,4-difluorophenyl)propane-1,2-diol

: 156570-12-6
(S)-3-chloro-2-(2,4-difluorophenyl)propane-1,2-diol

Guidance literature:: With Aspergillus niger epoxide hydrolase; In water; dimethyl sulfoxide; at 27 ℃; for 2h;
DOI:10.1016/j.tet.2003.10.119

Reference yield: 41.0%

: 164347-62-0
1,2-epoxy-3-chloro-2-(2,4-difluorophenyl)-propane

: (S)-1-chloro-2-(2,4-difluorophenyl)-2,3-epoxypropane

: 506439-68-5
(R)-3-chloro-2-(2,4-difluorophenyl)propane-1,2-diol

Guidance literature:: With phosphate buffer; epoxide hydrolase from Aspergillus niger; In dimethyl sulfoxide; at 27 ℃; for 4.75h; pH=7;
DOI:10.1016/S0957-4166(02)00681-X

Reference yield:

: 3-(2,4-difluorophenyl)oxetan-3-ol

: 506439-68-5
(R)-3-chloro-2-(2,4-difluorophenyl)propane-1,2-diol

: 156570-12-6
(S)-3-chloro-2-(2,4-difluorophenyl)propane-1,2-diol

Guidance literature:: 3-(2,4-difluorophenyl)oxetan-3-ol; With C₆₅H₈₃O₄P; magnesium sulfate; In water; benzene; for 0.166667h; Molecular sieve;

With chlorotrimethoxysilane; In water; benzene; at 20 ℃; for 24h; Overall yield = 95 %; Overall yield = 63.5 mg; enantioselective reaction; Molecular sieve;
DOI:10.1002/anie.201601844