Name: Name:3-(2,5-difluorophenyl)-1-methyl-1H-pyrazole-4-carboxylic acid
Brand: Angene
SKU: AG01BRSB
Rating: 90 (10 reviews)

3-(2,5-difluorophenyl)-1-methyl-1H-pyrazole-4-carboxylic acid

CAS No.:

1152548-65-6

Catalog Number:

AG01BRSB

Molecular Formula:

C11H8F2N2O2

Molecular Weight:

238.1902

Catalog Number:

AG01BRSB

Chemical Name:

3-(2,5-difluorophenyl)-1-methyl-1H-pyrazole-4-carboxylic acid

CAS Number:

1152548-65-6

Molecular Formula:

C11H8F2N2O2

Molecular Weight:

238.1902

MDL Number:

MFCD11180205

IUPAC Name:

3-(2,5-difluorophenyl)-1-methylpyrazole-4-carboxylic acid

InChI:

InChI=1S/C11H8F2N2O2/c1-15-5-8(11(16)17)10(14-15)7-4-6(12)2-3-9(7)13/h2-5H,1H3,(H,16,17)

InChI Key:

AXDQBQOZVFEFSZ-UHFFFAOYSA-N

SMILES:

Fc1ccc(c(c1)c1nn(cc1C(=O)O)C)F

Complexity:

303

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

238.055g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

238.194g/mol

Monoisotopic Mass:

238.055g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6