Name: Name:4-[5-(4-fluorophenyl)-1H-pyrazol-1-yl]benzoic acid
Brand: Angene
SKU: AG019X10
Rating: 90 (10 reviews)

4-[5-(4-fluorophenyl)-1H-pyrazol-1-yl]benzoic acid

CAS No.:

926237-30-1

Catalog Number:

AG019X10

Molecular Formula:

C16H11FN2O2

Molecular Weight:

282.2691

Catalog Number:

AG019X10

Chemical Name:

4-[5-(4-fluorophenyl)-1H-pyrazol-1-yl]benzoic acid

CAS Number:

926237-30-1

Molecular Formula:

C16H11FN2O2

Molecular Weight:

282.2691

MDL Number:

MFCD09048860

IUPAC Name:

4-[5-(4-fluorophenyl)pyrazol-1-yl]benzoic acid

InChI:

InChI=1S/C16H11FN2O2/c17-13-5-1-11(2-6-13)15-9-10-18-19(15)14-7-3-12(4-8-14)16(20)21/h1-10H,(H,20,21)

InChI Key:

QSVBYSXSSQFFRN-UHFFFAOYSA-N

SMILES:

Fc1ccc(cc1)c1ccnn1c1ccc(cc1)C(=O)O

Complexity:

363

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

282.08g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

282.274g/mol

Monoisotopic Mass:

282.08g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2