Name: Name:3-bromo-1-(4-fluorophenyl)-1H-pyrazole-5-carboxylic acid
Brand: Angene
SKU: AG01AAI5
Rating: 90 (10 reviews)

3-bromo-1-(4-fluorophenyl)-1H-pyrazole-5-carboxylic acid

CAS No.:

1251249-98-5

Catalog Number:

AG01AAI5

Molecular Formula:

C10H6BrFN2O2

Molecular Weight:

285.0692

Catalog Number:

AG01AAI5

Chemical Name:

3-bromo-1-(4-fluorophenyl)-1H-pyrazole-5-carboxylic acid

CAS Number:

1251249-98-5

Molecular Formula:

C10H6BrFN2O2

Molecular Weight:

285.0692

MDL Number:

MFCD16683349

IUPAC Name:

5-bromo-2-(4-fluorophenyl)pyrazole-3-carboxylic acid

InChI:

InChI=1S/C10H6BrFN2O2/c11-9-5-8(10(15)16)14(13-9)7-3-1-6(12)2-4-7/h1-5H,(H,15,16)

InChI Key:

MLNXUKVJHGFLCU-UHFFFAOYSA-N

SMILES:

Fc1ccc(cc1)n1nc(cc1C(=O)O)Br

Complexity:

272

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

283.96g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

285.072g/mol

Monoisotopic Mass:

283.96g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.9