Name: Name:1-(4-ethylphenyl)-1H,4H,5H,6H-cyclopenta[c]pyrazole-3-carboxylic acid
Brand: Angene
SKU: AG01AGL0
Rating: 90 (10 reviews)

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

CAS No.:

926204-51-5

Catalog Number:

AG01AGL0

Molecular Formula:

C15H16N2O2

Molecular Weight:

256.2997

Catalog Number:

AG01AGL0

Chemical Name:

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

CAS Number:

926204-51-5

Molecular Formula:

C15H16N2O2

Molecular Weight:

256.2997

MDL Number:

MFCD09044876

IUPAC Name:

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

InChI:

InChI=1S/C15H16N2O2/c1-2-10-6-8-11(9-7-10)17-13-5-3-4-12(13)14(16-17)15(18)19/h6-9H,2-5H2,1H3,(H,18,19)

InChI Key:

KLAZVKFCHQJCHS-UHFFFAOYSA-N

SMILES:

CCc1ccc(cc1)n1nc(c2c1CCC2)C(=O)O

Complexity:

339

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

256.121g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

256.305g/mol

Monoisotopic Mass:

256.121g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2