1H-Benzimidazole-4-carboxylic acid, 1-methyl-


Chemical Name: 1H-Benzimidazole-4-carboxylic acid, 1-methyl-
CAS Number: 672957-92-5
Product Number: AG00FGEH(AGN-PC-07A9I5)
Synonyms:
MDL No: MFCD09751736
Molecular Formula: C9H8N2O2
Molecular Weight: 176.1720

Identification/Properties


Computed Properties
Molecular Weight:
176.175g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
176.059g/mol
Monoisotopic Mass:
176.059g/mol
Topological Polar Surface Area:
55.1A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
220
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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