Name: Name:2-[(2,2-difluoroethyl)sulfanyl]-5-(trifluoromethyl)aniline
Brand: Angene
SKU: AG01AJZ7
Rating: 90 (10 reviews)

2-[(2,2-difluoroethyl)sulfanyl]-5-(trifluoromethyl)aniline

CAS No.:

1183293-41-5

Catalog Number:

AG01AJZ7

Molecular Formula:

C9H8F5NS

Molecular Weight:

257.2235

Catalog Number:

AG01AJZ7

Chemical Name:

2-[(2,2-difluoroethyl)sulfanyl]-5-(trifluoromethyl)aniline

CAS Number:

1183293-41-5

Molecular Formula:

C9H8F5NS

Molecular Weight:

257.2235

MDL Number:

MFCD12807580

IUPAC Name:

2-(2,2-difluoroethylsulfanyl)-5-(trifluoromethyl)aniline

InChI:

InChI=1S/C9H8F5NS/c10-8(11)4-16-7-2-1-5(3-6(7)15)9(12,13)14/h1-3,8H,4,15H2

InChI Key:

KPWYYXFLXMOIQM-UHFFFAOYSA-N

SMILES:

FC(CSc1ccc(cc1N)C(F)(F)F)F

Complexity:

220

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

257.03g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

257.222g/mol

Monoisotopic Mass:

257.03g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

51.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.5