Name: Name:5-(3-Fluoro-4-methylphenyl)nicotinic acid
Brand: Angene
SKU: AG000S80
Rating: 90 (10 reviews)

5-(3-Fluoro-4-methylphenyl)nicotinic acid

CAS No.:

1261946-42-2

Catalog Number:

AG000S80

Molecular Formula:

C13H10FNO2

Molecular Weight:

231.2224

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Catalog Number:

AG000S80

Chemical Name:

5-(3-Fluoro-4-methylphenyl)nicotinic acid

CAS Number:

1261946-42-2

Molecular Formula:

C13H10FNO2

Molecular Weight:

231.2224

MDL Number:

MFCD18317023

IUPAC Name:

5-(3-fluoro-4-methylphenyl)pyridine-3-carboxylic acid

InChI:

InChI=1S/C13H10FNO2/c1-8-2-3-9(5-12(8)14)10-4-11(13(16)17)7-15-6-10/h2-7H,1H3,(H,16,17)

InChI Key:

QTFPKJSSHWDDNP-UHFFFAOYSA-N

SMILES:

OC(=O)c1cncc(c1)c1ccc(c(c1)F)C

Complexity:

285

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

231.07g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

231.226g/mol

Monoisotopic Mass:

231.07g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

50.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.5