Name: Name:2-[(3,4-difluorophenyl)sulfanyl]-2-phenylacetic acid
Brand: Angene
SKU: AG01AB74
Rating: 90 (10 reviews)

2-[(3,4-difluorophenyl)sulfanyl]-2-phenylacetic acid

CAS No.:

1097125-23-9

Catalog Number:

AG01AB74

Molecular Formula:

C14H10F2O2S

Molecular Weight:

280.2898

Catalog Number:

AG01AB74

Chemical Name:

2-[(3,4-difluorophenyl)sulfanyl]-2-phenylacetic acid

CAS Number:

1097125-23-9

Molecular Formula:

C14H10F2O2S

Molecular Weight:

280.2898

MDL Number:

MFCD12654648

IUPAC Name:

2-(3,4-difluorophenyl)sulfanyl-2-phenylacetic acid

InChI:

InChI=1S/C14H10F2O2S/c15-11-7-6-10(8-12(11)16)19-13(14(17)18)9-4-2-1-3-5-9/h1-8,13H,(H,17,18)

InChI Key:

QZXBDUATFRTRPZ-UHFFFAOYSA-N

SMILES:

OC(=O)C(c1ccccc1)Sc1ccc(c(c1)F)F

Complexity:

308

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

280.037g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

280.289g/mol

Monoisotopic Mass:

280.037g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

62.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.9