Name: Name:5-(chlorodifluoromethyl)-1,3-dimethyl-1H-pyrazole-4-carboxylic acid
Brand: Angene
SKU: AG019RXP
Rating: 90 (10 reviews)

5-(chlorodifluoromethyl)-1,3-dimethyl-1H-pyrazole-4-carboxylic acid

CAS No.:

1384427-74-0

Catalog Number:

AG019RXP

Molecular Formula:

C7H7ClF2N2O2

Molecular Weight:

224.5925

Catalog Number:

AG019RXP

Chemical Name:

5-(chlorodifluoromethyl)-1,3-dimethyl-1H-pyrazole-4-carboxylic acid

CAS Number:

1384427-74-0

Molecular Formula:

C7H7ClF2N2O2

Molecular Weight:

224.5925

MDL Number:

MFCD22196672

IUPAC Name:

5-[chloro(difluoro)methyl]-1,3-dimethylpyrazole-4-carboxylic acid

InChI:

InChI=1S/C7H7ClF2N2O2/c1-3-4(6(13)14)5(7(8,9)10)12(2)11-3/h1-2H3,(H,13,14)

InChI Key:

GGPGOZUVJYLLKG-UHFFFAOYSA-N

SMILES:

OC(=O)c1c(C)nn(c1C(Cl)(F)F)C

Complexity:

252

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

224.016g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

224.592g/mol

Monoisotopic Mass:

224.016g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3