Name: Name:1-[1-METHYL-3-(TRIFLUOROMETHYL)-1H-PYRAZOL-5-YL]ETHANONE
Brand: Angene
SKU: AG01DUWH
Rating: 90 (10 reviews)

1-[1-METHYL-3-(TRIFLUOROMETHYL)-1H-PYRAZOL-5-YL]ETHANONE

CAS No.:

1006434-30-5

Catalog Number:

AG01DUWH

Molecular Formula:

C7H7F3N2O

Molecular Weight:

192.1385

Catalog Number:

AG01DUWH

Chemical Name:

1-[1-METHYL-3-(TRIFLUOROMETHYL)-1H-PYRAZOL-5-YL]ETHANONE

CAS Number:

1006434-30-5

Molecular Formula:

C7H7F3N2O

Molecular Weight:

192.1385

MDL Number:

MFCD04968850

IUPAC Name:

1-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]ethanone

InChI:

InChI=1S/C7H7F3N2O/c1-4(13)5-3-6(7(8,9)10)11-12(5)2/h3H,1-2H3

InChI Key:

VGYXGSWKLZXQRB-UHFFFAOYSA-N

SMILES:

CC(=O)c1cc(nn1C)C(F)(F)F

Complexity:

216

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

192.051g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

192.141g/mol

Monoisotopic Mass:

192.051g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

34.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2