Name: Name:3-Pyridazinecarboxylic acid, 1,6-dihydro-6-oxo-1-(phenylmethyl)-
Brand: Angene
SKU: AG00HZJZ
Rating: 90 (10 reviews)

3-Pyridazinecarboxylic acid, 1,6-dihydro-6-oxo-1-(phenylmethyl)-

CAS No.:

171673-00-0

Catalog Number:

AG00HZJZ

Molecular Formula:

C12H10N2O3

Molecular Weight:

230.2194

Catalog Number:

AG00HZJZ

Chemical Name:

3-Pyridazinecarboxylic acid, 1,6-dihydro-6-oxo-1-(phenylmethyl)-

CAS Number:

171673-00-0

Molecular Formula:

C12H10N2O3

Molecular Weight:

230.2194

MDL Number:

MFCD03965721

IUPAC Name:

1-benzyl-6-oxopyridazine-3-carboxylic acid

InChI:

InChI=1S/C12H10N2O3/c15-11-7-6-10(12(16)17)13-14(11)8-9-4-2-1-3-5-9/h1-7H,8H2,(H,16,17)

InChI Key:

MTSJTBMELMDWBI-UHFFFAOYSA-N

SMILES:

OC(=O)c1ccc(=O)n(n1)Cc1ccccc1

Complexity:

381

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

230.069g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

230.223g/mol

Monoisotopic Mass:

230.069g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

70A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.9