Name: Name:1-(3-fluorophenyl)-3-methyl-1H-pyrazole-4-carboxylic acid
Brand: Angene
SKU: AG01C2K9
Rating: 90 (10 reviews)

1-(3-fluorophenyl)-3-methyl-1H-pyrazole-4-carboxylic acid

CAS No.:

1250985-70-6

Catalog Number:

AG01C2K9

Molecular Formula:

C11H9FN2O2

Molecular Weight:

220.1998

Catalog Number:

AG01C2K9

Chemical Name:

1-(3-fluorophenyl)-3-methyl-1H-pyrazole-4-carboxylic acid

CAS Number:

1250985-70-6

Molecular Formula:

C11H9FN2O2

Molecular Weight:

220.1998

MDL Number:

MFCD14690591

IUPAC Name:

1-(3-fluorophenyl)-3-methylpyrazole-4-carboxylic acid

InChI:

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

InChI Key:

WPHZWRNCRXEJOB-UHFFFAOYSA-N

SMILES:

Fc1cccc(c1)n1nc(c(c1)C(=O)O)C

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:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9