Name: Name:1-(4-fluorophenyl)-5-propyl-1H-pyrazole-4-carboxylic acid
Brand: Angene
SKU: AG01A5XD
Rating: 90 (10 reviews)

1-(4-fluorophenyl)-5-propyl-1H-pyrazole-4-carboxylic acid

CAS No.:

924644-70-2

Catalog Number:

AG01A5XD

Molecular Formula:

C13H13FN2O2

Molecular Weight:

248.2529

Catalog Number:

AG01A5XD

Chemical Name:

1-(4-fluorophenyl)-5-propyl-1H-pyrazole-4-carboxylic acid

CAS Number:

924644-70-2

Molecular Formula:

C13H13FN2O2

Molecular Weight:

248.2529

MDL Number:

MFCD11531312

IUPAC Name:

1-(4-fluorophenyl)-5-propylpyrazole-4-carboxylic acid

InChI:

InChI=1S/C13H13FN2O2/c1-2-3-12-11(13(17)18)8-15-16(12)10-6-4-9(14)5-7-10/h4-8H,2-3H2,1H3,(H,17,18)

InChI Key:

VEORDRZPVCZNOY-UHFFFAOYSA-N

SMILES:

CCCc1c(cnn1c1ccc(cc1)F)C(=O)O

Complexity:

293

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

248.096g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

248.257g/mol

Monoisotopic Mass:

248.096g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.7