Name: Name:2-fluoro-5-(3-methyl-1H-pyrazol-4-yl)benzoic acid
Brand: Angene
SKU: AG01ELEA
Rating: 90 (10 reviews)

2-fluoro-5-(3-methyl-1H-pyrazol-4-yl)benzoic acid

CAS No.:

2138370-38-2

Catalog Number:

AG01ELEA

Molecular Formula:

C11H9FN2O2

Molecular Weight:

220.1998

Catalog Number:

AG01ELEA

Chemical Name:

2-fluoro-5-(3-methyl-1H-pyrazol-4-yl)benzoic acid

CAS Number:

2138370-38-2

Molecular Formula:

C11H9FN2O2

Molecular Weight:

220.1998

MDL Number:

MFCD31600563

IUPAC Name:

2-fluoro-5-(5-methyl-1H-pyrazol-4-yl)benzoic acid

InChI:

InChI=1S/C11H9FN2O2/c1-6-9(5-13-14-6)7-2-3-10(12)8(4-7)11(15)16/h2-5H,1H3,(H,13,14)(H,15,16)

InChI Key:

BZHYYNIVGJPIDB-UHFFFAOYSA-N

SMILES:

OC(=O)c1cc(ccc1F)c1c[nH]nc1C

Complexity:

275

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

220.065g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

220.203g/mol

Monoisotopic Mass:

220.065g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9