Name: Name:1-(3,5-difluorophenyl)-1H,4H,5H,6H-cyclopenta[c]pyrazole-3-carboxylic acid
Brand: Angene
SKU: AG01C4BW
Rating: 90 (10 reviews)

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

CAS No.:

926207-33-2

Catalog Number:

AG01C4BW

Molecular Formula:

C13H10F2N2O2

Molecular Weight:

264.2275

Catalog Number:

AG01C4BW

Chemical Name:

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

CAS Number:

926207-33-2

Molecular Formula:

C13H10F2N2O2

Molecular Weight:

264.2275

MDL Number:

MFCD09045346

IUPAC Name:

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

InChI:

InChI=1S/C13H10F2N2O2/c14-7-4-8(15)6-9(5-7)17-11-3-1-2-10(11)12(16-17)13(18)19/h4-6H,1-3H2,(H,18,19)

InChI Key:

PNQRRJZHLKZNGZ-UHFFFAOYSA-N

SMILES:

Fc1cc(F)cc(c1)n1nc(c2c1CCC2)C(=O)O

Complexity:

359

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

264.071g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

264.232g/mol

Monoisotopic Mass:

264.071g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6