Name: Name:1-(4-chloro-2-(5-methyl-1H-pyrazol-1-yl)phenyl)-2,2,2-trifluoroethanone
Brand: Angene
SKU: AG01DJ1P
Rating: 90 (10 reviews)

1-(4-chloro-2-(5-methyl-1H-pyrazol-1-yl)phenyl)-2,2,2-trifluoroethanone

CAS No.:

1125828-32-1

Catalog Number:

AG01DJ1P

Molecular Formula:

C12H8ClF3N2O

Molecular Weight:

288.6529

Catalog Number:

AG01DJ1P

Chemical Name:

1-(4-chloro-2-(5-methyl-1H-pyrazol-1-yl)phenyl)-2,2,2-trifluoroethanone

CAS Number:

1125828-32-1

Molecular Formula:

C12H8ClF3N2O

Molecular Weight:

288.6529

MDL Number:

MFCD30188678

IUPAC Name:

1-[4-chloro-2-(5-methylpyrazol-1-yl)phenyl]-2,2,2-trifluoroethanone

InChI:

InChI=1S/C12H8ClF3N2O/c1-7-4-5-17-18(7)10-6-8(13)2-3-9(10)11(19)12(14,15)16/h2-6H,1H3

InChI Key:

DPXBCYTZBHTXIX-UHFFFAOYSA-N

SMILES:

Clc1ccc(c(c1)n1nccc1C)C(=O)C(F)(F)F

Complexity:

350

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

288.028g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

288.654g/mol

Monoisotopic Mass:

288.028g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

34.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.7