Name: Name:1-(4-fluorophenyl)-3-(4-methylphenyl)-1H-pyrazole-4-carboxylic acid
Brand: Angene
SKU: AG00IJC5
Rating: 90 (10 reviews)

1-(4-fluorophenyl)-3-(4-methylphenyl)-1H-pyrazole-4-carboxylic acid

CAS No.:

956779-12-7

Catalog Number:

AG00IJC5

Molecular Formula:

C17H13FN2O2

Molecular Weight:

296.2957

Catalog Number:

AG00IJC5

Chemical Name:

1-(4-fluorophenyl)-3-(4-methylphenyl)-1H-pyrazole-4-carboxylic acid

CAS Number:

956779-12-7

Molecular Formula:

C17H13FN2O2

Molecular Weight:

296.2957

MDL Number:

MFCD06357437

IUPAC Name:

1-(4-fluorophenyl)-3-(4-methylphenyl)pyrazole-4-carboxylic acid

InChI:

InChI=1S/C17H13FN2O2/c1-11-2-4-12(5-3-11)16-15(17(21)22)10-20(19-16)14-8-6-13(18)7-9-14/h2-10H,1H3,(H,21,22)

InChI Key:

SLCBEWVMMQNFTN-UHFFFAOYSA-N

SMILES:

Cc1ccc(cc1)c1nn(cc1C(=O)O)c1ccc(cc1)F

Complexity:

390

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

296.096g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

296.301g/mol

Monoisotopic Mass:

296.096g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.5