Name: Name:4-(2-hydroxyethyl)-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazole-3-carboxylic acid
Brand: Angene
SKU: AG019V0D
Rating: 90 (10 reviews)

4-(2-hydroxyethyl)-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazole-3-carboxylic acid

CAS No.:

1146290-27-8

Catalog Number:

AG019V0D

Molecular Formula:

C12H12N2O4

Molecular Weight:

248.2347

Catalog Number:

AG019V0D

Chemical Name:

4-(2-hydroxyethyl)-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazole-3-carboxylic acid

CAS Number:

1146290-27-8

Molecular Formula:

C12H12N2O4

Molecular Weight:

248.2347

MDL Number:

MFCD11656478

IUPAC Name:

4-(2-hydroxyethyl)-5-oxo-1-phenyl-4H-pyrazole-3-carboxylic acid

InChI:

InChI=1S/C12H12N2O4/c15-7-6-9-10(12(17)18)13-14(11(9)16)8-4-2-1-3-5-8/h1-5,9,15H,6-7H2,(H,17,18)

InChI Key:

RECYHGJQIKPRDX-UHFFFAOYSA-N

SMILES:

OCCC1C(=O)N(N=C1C(=O)O)c1ccccc1

Complexity:

374

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

248.08g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

248.238g/mol

Monoisotopic Mass:

248.08g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

90.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.6