Name: Name:1H-Pyrazole-3-carboxylic acid, 1-(4-fluorophenyl)-5-methyl-
Brand: Angene
SKU: AG002WNY
Rating: 90 (10 reviews)

1H-Pyrazole-3-carboxylic acid, 1-(4-fluorophenyl)-5-methyl-

CAS No.:

288251-66-1

Catalog Number:

AG002WNY

Molecular Formula:

C11H9FN2O2

Molecular Weight:

220.1998

Catalog Number:

AG002WNY

Chemical Name:

1H-Pyrazole-3-carboxylic acid, 1-(4-fluorophenyl)-5-methyl-

CAS Number:

288251-66-1

Molecular Formula:

C11H9FN2O2

Molecular Weight:

220.1998

MDL Number:

MFCD08443741

IUPAC Name:

1-(4-fluorophenyl)-5-methylpyrazole-3-carboxylic acid

InChI:

InChI=1S/C11H9FN2O2/c1-7-6-10(11(15)16)13-14(7)9-4-2-8(12)3-5-9/h2-6H,1H3,(H,15,16)

InChI Key:

VYEZQNYDNQBJNA-UHFFFAOYSA-N

SMILES:

Fc1ccc(cc1)n1nc(cc1C)C(=O)O

Complexity:

267

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

220.065g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

220.203g/mol

Monoisotopic Mass:

220.065g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3