Name: Name:1H-INDAZOLE-6-CARBOXYLIC ACID, 2,3-DIHYDRO-3-OXO-
Brand: Angene
SKU: AG01EK95
Rating: 90 (10 reviews)

1H-INDAZOLE-6-CARBOXYLIC ACID, 2,3-DIHYDRO-3-OXO-

CAS No.:

862274-40-6

Catalog Number:

AG01EK95

Molecular Formula:

C8H6N2O3

Molecular Weight:

178.1448

Catalog Number:

AG01EK95

Chemical Name:

1H-INDAZOLE-6-CARBOXYLIC ACID, 2,3-DIHYDRO-3-OXO-

CAS Number:

862274-40-6

Molecular Formula:

C8H6N2O3

Molecular Weight:

178.1448

MDL Number:

MFCD16619977

IUPAC Name:

3-oxo-1,2-dihydroindazole-6-carboxylic acid

InChI:

InChI=1S/C8H6N2O3/c11-7-5-2-1-4(8(12)13)3-6(5)9-10-7/h1-3H,(H,12,13)(H2,9,10,11)

InChI Key:

QASUNHBHNOVFQK-UHFFFAOYSA-N

SMILES:

OC(=O)c1ccc2c(c1)[nH][nH]c2=O

Complexity:

254

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

178.038g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

178.147g/mol

Monoisotopic Mass:

178.038g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

78.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.7