Name: Name:1-{4-[(2,2,2-trifluoroethyl)sulfanyl]phenyl}ethan-1-one
Brand: Angene
SKU: AG019PVF
Rating: 90 (10 reviews)

1-{4-[(2,2,2-trifluoroethyl)sulfanyl]phenyl}ethan-1-one

CAS No.:

1328939-64-5

Catalog Number:

AG019PVF

Molecular Formula:

C10H9F3OS

Molecular Weight:

234.2381

Catalog Number:

AG019PVF

Chemical Name:

1-{4-[(2,2,2-trifluoroethyl)sulfanyl]phenyl}ethan-1-one

CAS Number:

1328939-64-5

Molecular Formula:

C10H9F3OS

Molecular Weight:

234.2381

MDL Number:

MFCD20306140

IUPAC Name:

1-[4-(2,2,2-trifluoroethylsulfanyl)phenyl]ethanone

InChI:

InChI=1S/C10H9F3OS/c1-7(14)8-2-4-9(5-3-8)15-6-10(11,12)13/h2-5H,6H2,1H3

InChI Key:

UAFDTIBXBXGJFF-UHFFFAOYSA-N

SMILES:

CC(=O)c1ccc(cc1)SCC(F)(F)F

Complexity:

219

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

234.033g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

234.236g/mol

Monoisotopic Mass:

234.033g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

42.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2