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CAS Number: 188106-94-7
2-methyl-1H-benzo[d]imidazole-7-carboxylic acid

Structure

2-methyl-1H-benzo[d]imidazole-7-carboxylic acid
Name: 2-methyl-1H-benzo[d]imidazole-7-carboxylic acid
Synonyms:
General Information
Product Number: 188106947
CAS Registry Number: 188106-94-7
Name:
        1H-​Benzimidazole-​7-​carboxylic acid, 2-​methyl-
        1H-​Benzimidazole-​4-​carboxylic acid, 2-​methyl- (9CI); 2-​Methyl-​1H-​benzimidazole-​4-​carboxylic acid 
 
Chemical Formula: C9H8N2O2
Exact Mass: 176.06
Molecular Weight: 176.17
m/z: 176.06 (100.0%), 177.06 (10.6%)
Elemental Analysis: C, 61.36; H, 4.58; N, 15.90; O, 18.16
 
InChI: InChI=1S/C9H8N2O2/c1-5-10-7-4-2-3-6(9(12)13)8(7)11-5/h2-4H,1H3,(H,10,11)(H,12,13)
InChIKey: LVUZVFVJPPDROZ-UHFFFAOYSA-N
Canonical SMILES : CC1=NC2=C(C=CC=C2N1)C(=O)O
 
Thermal Properties Value Condition Note
Melting Point 188-191 °C   (1)CAS

Specification

98%

References
  1. (1) White, Alex W.; Journal of Medicinal Chemistry 2000, V43(22), P4084-4097 CAPLUS
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