Name: Name:3-(DifluoroMethyl)-5-fluoro-1-Methyl-1H-Pyrazole-4-carboxylic acid
Brand: Angene
SKU: AG009XCM
Rating: 90 (10 reviews)

3-(DifluoroMethyl)-5-fluoro-1-Methyl-1H-Pyrazole-4-carboxylic acid

CAS No.:

1255735-09-1

Catalog Number:

AG009XCM

Molecular Formula:

C6H5F3N2O2

Molecular Weight:

194.1113

Catalog Number:

AG009XCM

Chemical Name:

3-(DifluoroMethyl)-5-fluoro-1-Methyl-1H-Pyrazole-4-carboxylic acid

CAS Number:

1255735-09-1

Molecular Formula:

C6H5F3N2O2

Molecular Weight:

194.1113

MDL Number:

MFCD20646221

IUPAC Name:

3-(difluoromethyl)-5-fluoro-1-methylpyrazole-4-carboxylic acid

InChI:

InChI=1S/C6H5F3N2O2/c1-11-5(9)2(6(12)13)3(10-11)4(7)8/h4H,1H3,(H,12,13)

InChI Key:

AXJCNOQHTJLWDH-UHFFFAOYSA-N

SMILES:

FC(c1nn(c(c1C(=O)O)F)C)F

Complexity:

214

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

194.03g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

194.113g/mol

Monoisotopic Mass:

194.03g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8