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CAS Number: 68701-22-4
2-amino-5-isopropylbenzoic acid

Structure

2-amino-5-isopropylbenzoic acid
Name: 2-amino-5-isopropylbenzoic acid
Synonyms:
General Information
Product Number: 68701224

CAS Registry Number 68701-22-4
Name:
Benzoic acid, 2-​amino-​5-​(1-​methylethyl)​-
2-Amino-5-(1-methylethyl)benzoic acid
2-Amino-5-isopropylbenzoic acid
5-Isopropylanthranilic acid

 

Chemical Formula: C10H13NO2
Exact Mass: 179.09
Molecular Weight: 179.22
m/z: 179.09 (100.0%), 180.10 (11.0%), 181.10 (1.0%)

 

InChI:InChI=1S/C10H13NO2/c1-6(2)7-3-4-9(11)8(5-7)10(12)13/h3-6H,11H2,1-2H3,(H,12,13)

InChI Key:QWNMKHLBVHTPFW-UHFFFAOYSA-N

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

 

Thermal Properties Value Condition Note
Melting Point 84-92 °C   (1)IC

Specification

98%

References
  1. (1) Tilley, Jefferson W.; Journal of Medicinal Chemistry 1980, V23(1), P92-5 CAPLUS
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