Name: Name:3-methyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-carboxylic acid
Brand: Angene
SKU: AG01A1YQ
Rating: 90 (10 reviews)

3-methyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-carboxylic acid

CAS No.:

863564-77-6

Catalog Number:

AG01A1YQ

Molecular Formula:

C9H8N2O3

Molecular Weight:

192.1714

Catalog Number:

AG01A1YQ

Chemical Name:

3-methyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-carboxylic acid

CAS Number:

863564-77-6

Molecular Formula:

C9H8N2O3

Molecular Weight:

192.1714

MDL Number:

MFCD20641930

IUPAC Name:

3-methyl-2-oxo-1H-benzimidazole-5-carboxylic acid

InChI:

InChI=1S/C9H8N2O3/c1-11-7-4-5(8(12)13)2-3-6(7)10-9(11)14/h2-4H,1H3,(H,10,14)(H,12,13)

InChI Key:

QNGRDARNLFTZBH-UHFFFAOYSA-N

SMILES:

OC(=O)c1ccc2c(c1)n(C)c(=O)[nH]2

Complexity:

279

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

192.053g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

192.174g/mol

Monoisotopic Mass:

192.053g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

69.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.3