Name: Name:1-(3-methylphenyl)-1H-1,3-benzodiazole-5-carboxylic acid
Brand: Angene
SKU: AG01B5CF
Rating: 90 (10 reviews)

1-(3-methylphenyl)-1H-1,3-benzodiazole-5-carboxylic acid

CAS No.:

452088-76-5

Catalog Number:

AG01B5CF

Molecular Formula:

C15H12N2O2

Molecular Weight:

252.2680

Catalog Number:

AG01B5CF

Chemical Name:

1-(3-methylphenyl)-1H-1,3-benzodiazole-5-carboxylic acid

CAS Number:

452088-76-5

Molecular Formula:

C15H12N2O2

Molecular Weight:

252.2680

MDL Number:

MFCD02939961

IUPAC Name:

1-(3-methylphenyl)benzimidazole-5-carboxylic acid

InChI:

InChI=1S/C15H12N2O2/c1-10-3-2-4-12(7-10)17-9-16-13-8-11(15(18)19)5-6-14(13)17/h2-9H,1H3,(H,18,19)

InChI Key:

BRRXKUBZCCPROK-UHFFFAOYSA-N

SMILES:

Cc1cccc(c1)n1cnc2c1ccc(c2)C(=O)O

Complexity:

347

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

252.09g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

252.273g/mol

Monoisotopic Mass:

252.09g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3: