Name: Name:1H-Pyrazole-3-carboxylicacid, 1-(3-aminophenyl)-4,5-dihydro-5-oxo-
Brand: Angene
SKU: AG0041Q7
Rating: 90 (10 reviews)

1H-Pyrazole-3-carboxylicacid, 1-(3-aminophenyl)-4,5-dihydro-5-oxo-

CAS No.:

89-26-9

Catalog Number:

AG0041Q7

Molecular Formula:

C10H9N3O3

Molecular Weight:

219.1968

Catalog Number:

AG0041Q7

Chemical Name:

1H-Pyrazole-3-carboxylicacid, 1-(3-aminophenyl)-4,5-dihydro-5-oxo-

CAS Number:

89-26-9

Molecular Formula:

C10H9N3O3

Molecular Weight:

219.1968

MDL Number:

MFCD00043812

IUPAC Name:

1-(3-aminophenyl)-5-oxo-4H-pyrazole-3-carboxylic acid

InChI:

InChI=1S/C10H9N3O3/c11-6-2-1-3-7(4-6)13-9(14)5-8(12-13)10(15)16/h1-4H,5,11H2,(H,15,16)

InChI Key:

SWHUGXBRBHHKFB-UHFFFAOYSA-N

SMILES:

Nc1cccc(c1)N1N=C(CC1=O)C(=O)O

EC Number:

201-892-6

NSC Number:

4987

Complexity:

353

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

219.064g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

219.2g/mol

Monoisotopic Mass:

219.064g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

96A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.2