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CAS Number: 876710-76-8
6-fluoro-1H-benzo[d]imidazole-2-carboxylic acid

Structure

6-fluoro-1H-benzo[d]imidazole-2-carboxylic acid
Name: 6-fluoro-1H-benzo[d]imidazole-2-carboxylic acid
Synonyms:
General Information
Product Number: 876710768

CAS Registry Number: 876710-76-8

Name:

1H-​Benzimidazole-​2-​carboxylic acid, 6-​fluoro-
1H-​Benzimidazole-​2-​carboxylic acid, 5-​fluoro- (9CI); 5-​Fluoro-​1H-​benzimidazole-​2-​carboxylic acid 

 

Chemical Formula: C8H5FN2O2
Exact Mass: 180.03
Molecular Weight: 180.14
m/z: 180.03 (100.0%), 181.04 (8.8%)

 

InChI: InChI=1S/C8H5FN2O2/c9-4-1-2-5-6(3-4)11-7(10-5)8(12)13/h1-3H,(H,10,11)(H,12,13)
InChIKey: TYXHLKWWJIWESF-UHFFFAOYSA-N
Canonical SMILES : C1=CC2=C(C=C1F)NC(=N2)C(=O)O

Specification

98%

References

(1) Allen, Jennifer R.; WO 2011143365 A1 2011 CAPLUS

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