Name: Name:2-Thioxo-2,3-dihydro-1H-benzo[d]imidazole-4-carboxylic acid
Brand: Angene
SKU: AG005FV2
Rating: 90 (10 reviews)

2-Thioxo-2,3-dihydro-1H-benzo[d]imidazole-4-carboxylic acid

CAS No.:

731742-58-8

Catalog Number:

AG005FV2

Molecular Formula:

C8H6N2O2S

Molecular Weight:

194.2104

Catalog Number:

AG005FV2

Chemical Name:

2-Thioxo-2,3-dihydro-1H-benzo[d]imidazole-4-carboxylic acid

CAS Number:

731742-58-8

Molecular Formula:

C8H6N2O2S

Molecular Weight:

194.2104

MDL Number:

MFCD06797236

IUPAC Name:

2-sulfanylidene-1,3-dihydrobenzimidazole-4-carboxylic acid

InChI:

InChI=1S/C8H6N2O2S/c11-7(12)4-2-1-3-5-6(4)10-8(13)9-5/h1-3H,(H,11,12)(H2,9,10,13)

InChI Key:

OMHCHRXJJPSEBZ-UHFFFAOYSA-N

SMILES:

OC(=O)c1cccc2c1[nH]c(=S)[nH]2

Complexity:

257

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

194.015g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

194.208g/mol

Monoisotopic Mass:

194.015g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

93.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.7