CAS Registry Number 3260-89-7
Name:
Benzoic acid, 2-?chloro-?6-?methoxy-
o-Anisic acid, 6-chloro- (7CI,8CI)
2-Chloro-6-methoxybenzoic acid
2-Chloro-6-(methyloxy)benzoic acid

Chemical Formula: C8H7ClO3
Exact Mass: 186.01
Molecular Weight: 186.59
m/z: 186.01 (100.0%), 188.01 (32.6%), 187.01 (8.8%), 189.01 (2.8%)

InChI:InChI=1S/C8H7ClO3/c1-12-6-4-2-3-5(9)7(6)8(10)11/h2-4H,1H3,(H,10,11)

InChI Key:JUOHBAJZQDTICO-UHFFFAOYSA-N

Canonical SMILES:COC1=C(C(=CC=C1)Cl)C(=O)O

Specification

98%

1. (1) Nguyen, Thi-Huu; Journal of Organic Chemistry 2007, V72(9), P3419-3429 CAPLUS
2. (2) Nguyen, Thi-Huu; Organic Letters 2006, V8(4), P765-768 CAPLUS
3. (4) Ullmann, Fritz; Justus Liebigs Annalen der Chemie 1907, V350, P108-17 CAPLUS