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CAS Number: 7053-88-5
2-hydroxy-3-isopropylbenzoic acid

Structure

2-hydroxy-3-isopropylbenzoic acid
Name: 2-hydroxy-3-isopropylbenzoic acid
Synonyms:
General Information
Product Number: 7053885

CAS Registry Number 7053-88-5
Name:
Benzoic acid, 2-​hydroxy-​3-​(1-​methylethyl)​-
Salicylic acid, 3-isopropyl- (6CI,7CI,8CI)
2-Hydroxy-3-(1-methylethyl)benzoic acid
2-Hydroxy-3-isopropylbenzoic acid
3-Isopropyl-2-hydroxybenzoic acid
3-Isopropylsalicylic acid

 

Chemical Formula: C10H12O3
Exact Mass: 180.08
Molecular Weight: 180.20
m/z: 180.08 (100.0%), 181.08 (11.1%)

 

InChI:InChI=1S/C10H12O3/c1-6(2)7-4-3-5-8(9(7)11)10(12)13/h3-6,11H,1-2H3,(H,12,13)

InChI Key:XGAYQDWZIPRBPF-UHFFFAOYSA-N

Canonical SMILES:CC(C)C1=CC=CC(=C1O)C(=O)O

 

Thermal Properties Value Condition Note
Melting Point 71-72 °C   (3)CAS
Melting Point 69-70 °C   (4)CAS
Melting Point 68-70 °C Solv: hexane (110-54-3) (5)IC

Specification

98%

References
  1. (3) Seki, Shigeo; Nippon Kagaku Zasshi 1959, V80, P667-71 CAPLUS
  2. (4) Zavarin, Eugene; Journal of Organic Chemistry 1961, V26, P173-6 CAPLUS
  3. (5) Harris, Thomas D.; Tetrahedron 1987, V43(7), P1519-40 CAPLUS
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