(S)-(+)-2-Chloromandelic acid

Base Information Edit

Chemical Name:(S)-(+)-2-Chloromandelic acid
CAS No.:52950-19-3
Molecular Formula:C₈H₇ClO₃
Molecular Weight:186.595
Hs Code.:29181990
European Community (EC) Number:700-307-6,610-918-9
UNII:P3948WAT0C
DSSTox Substance ID:DTXSID201312276
Nikkaji Number:J1.595.442F
Mol file:52950-19-3.mol

Synonyms:52950-19-3;(S)-(+)-2-Chloromandelic acid;(S)-2-(2-Chlorophenyl)-2-hydroxyacetic acid;(S)-2-Chloromandelic acid;(2S)-2-(2-chlorophenyl)-2-hydroxyacetic acid;P3948WAT0C;MFCD00798437;(s)-o-chloromandelic acid;2-Chloro-L-mandelic Acid;UNII-P3948WAT0C;S-O-CHLOROMANDELICACID;EC 700-307-6;(S)-(+)-2-(2-Chlorophenyl)-2-hydroxyacetic acid;(2S)-2-(2-chlorophenyl)-2-hydroxy-acetic acid;(S)-2'-Chloromandelic acid;SCHEMBL197618;S-(+)-2-Chloromandelic acid;RWOLDZZTBNYTMS-ZETCQYMHSA-N;DTXSID201312276;(+)-2-CHLOROMANDELIC ACID;(S)-2-Chloromandelic acid, 99%;RWJ-333369 METABOLITE M5;AKOS015889820;CS-W002685;(S)-(+)-2-Chloromandelic acid, 97%;AC-10661;AS-30993;C2738;(S)-2'-Chloro-alpha-hydroxyphenylacetic Acid;A870862;R288222;Q-201692;BENZENEACETIC ACID, 2-CHLORO-.ALPHA.-HYDROXY-, (S)-;BENZENEACETIC ACID, 2-CHLORO-.ALPHA.-HYDROXY-, (.ALPHA.S)-

Suppliers and Price of (S)-(+)-2-Chloromandelic acid

Supply Marketing:Edit

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

TRC
(S)-(+)-2-Chloromandelic acid
5g
$ 130.00

TCI Chemical
2-Chloro-L-mandelic Acid >98.0%(GC)(T)
25g
$ 245.00

TCI Chemical
2-Chloro-L-mandelic Acid >98.0%(GC)(T)
5g
$ 73.00

Sigma-Aldrich
(S)-(+)-2-Chloromandelic acid 97%
500mg
$ 38.80

Crysdot
(S)-2-(2-Chlorophenyl)-2-hydroxyaceticacid 97%
25g
$ 92.00

Chem-Impex
2-Chloro-L-mandelicacid,98%(Assaybytitration,Chiralpurity,GC) 98%(Assaybytitration,Chiralpurity,GC)
25G
$ 282.24

Chem-Impex
2-Chloro-L-mandelicacid,98%(Assaybytitration,Chiralpurity,GC) 98%(Assaybytitration,Chiralpurity,GC)
5G
$ 75.04

Biosynth Carbosynth
(S)-2-Chloromandelic acid
2 g
$ 363.40

Biosynth Carbosynth
(S)-2-Chloromandelic acid
5 g
$ 660.70

Biosynth Carbosynth
(S)-2-Chloromandelic acid
10 g
$ 1201.20

Total 99 raw suppliers

Chemical Property of (S)-(+)-2-Chloromandelic acid Edit

Chemical Property:

Appearance/Colour:white to light yellow crystal powder
Melting Point:118-121 °C(lit.)
Boiling Point:350.3 °C at 760 mmHg
PKA:3.30±0.10(Predicted)
Flash Point:165.7 °C
PSA：57.53000
Density:1.468 g/cm³
LogP:1.45800
Storage Temp.:Refrigerator
Solubility.:Methanol, Water
XLogP3:1.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:186.0083718
Heavy Atom Count:12
Complexity:172

Purity/Quality:

99% ^*data from raw suppliers

(S)-(+)-2-Chloromandelic acid ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 37/39-26-36

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C(=C1)C(C(=O)O)O)Cl
Isomeric SMILES:C1=CC=C(C(=C1)[C@@H](C(=O)O)O)Cl
Uses (S)-2-Chloromandelic acid can be used for chiral resolutions.

Technology Process of (S)-(+)-2-Chloromandelic acid

There total 67 articles about (S)-(+)-2-Chloromandelic 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: 93.2%

: 121986-01-4
(R)-2-chloromandelonitrile

: 10421-85-9,52923-23-6,52950-19-3,52950-18-2
(R)-2-chloromandelic acid

Guidance literature:: (R)-2-chloromandelonitrile; With hydrogenchloride; In water; at 60 ℃; for 7h;

With sodium hydroxide; In toluene; at 10 ℃; for 4h;