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CAS Number: 15068-35-6
2-Chloro-3-methylbenzoic acid

Structure

2-Chloro-3-methylbenzoic acid
Name: 2-Chloro-3-methylbenzoic acid
Synonyms:
General Information
Product Number: 15068356
CAS Number:
15068-35-6
Name:
Benzoic acid,2-chloro-3-methyl-
m-Toluic acid, 2-chloro- (6CI,7CI,8CI); 2-Chloro-3-methylbenzoic acid 
 
Chemical Formula: C8H7ClO2
Exact Mass: 170.01
Molecular Weight: 170.59
m/z: 170.01 (100.0%), 172.01 (32.0%), 171.02 (8.8%), 173.01 (2.8%)
Elemental Analysis: C, 56.32; H, 4.14; Cl, 20.78; O, 18.76
 
InChI: InChI=1S/C8H7ClO2/c1-5-3-2-4-6(7(5)9)8(10)11/h2-4H,1H3,(H,10,11)
InChIKey: LWOKLXMNGXXORN-UHFFFAOYSA-N
Canonical SMILES : CC1=CC=CC(=C1Cl)C(=O)O
 
 
Thermal Properties Value Condition Note
Melting Point 153 °C   (1)CAS
Melting Point 138-140 °C   (2)CAS
Melting Point 138-140 °C Solv: water (7732-18-5); ethanol (64-17-5) (3)CAS
Melting Point 138 °C   (4)CAS

Specification

98%

References
  1. (1) Stempel, Guido H., Jr.; Journal of the American Chemical Society 1950, V72, P4314-15 CAPLUS
  2. (2) Ablondi, Frank; Journal of Organic Chemistry 1952, V17, P157-63 CAPLUS
  3. (3) Archer, S.; Journal of the American Chemical Society 1952, V74, P4296-309 CAPLUS
  4. (4) Angadiyavar, Channabasappa S.; Journal of the Karnatak University 1966, V11, P52-8 CAPLUS
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