Name: Name:1-(3-fluoro-5-methylphenyl)-1H,4H,5H,6H-cyclopenta[c]pyrazole-3-carboxylic acid
Brand: Angene
SKU: AG01C3QE
Rating: 90 (10 reviews)

1-(3-fluoro-5-methylphenyl)-1H,4H,5H,6H-cyclopenta[c]pyrazole-3-carboxylic acid

CAS No.:

1519828-13-7

Catalog Number:

AG01C3QE

Molecular Formula:

C14H13FN2O2

Molecular Weight:

260.2636

Catalog Number:

AG01C3QE

Chemical Name:

1-(3-fluoro-5-methylphenyl)-1H,4H,5H,6H-cyclopenta[c]pyrazole-3-carboxylic acid

CAS Number:

1519828-13-7

Molecular Formula:

C14H13FN2O2

Molecular Weight:

260.2636

MDL Number:

MFCD22231603

IUPAC Name:

1-(3-fluoro-5-methylphenyl)-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carboxylic acid

InChI:

InChI=1S/C14H13FN2O2/c1-8-5-9(15)7-10(6-8)17-12-4-2-3-11(12)13(16-17)14(18)19/h5-7H,2-4H2,1H3,(H,18,19)

InChI Key:

BKJSRNBENDEASR-UHFFFAOYSA-N

SMILES:

Cc1cc(F)cc(c1)n1nc(c2c1CCC2)C(=O)O

Complexity:

365

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

260.096g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

260.268g/mol

Monoisotopic Mass:

260.096g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.9