Name: Name:3-cyano-4-fluoro-N-(2,2,2-trifluoroethyl)benzene-1-sulfonamide
Brand: Angene
SKU: AG01A0AB
Rating: 90 (10 reviews)

3-cyano-4-fluoro-N-(2,2,2-trifluoroethyl)benzene-1-sulfonamide

CAS No.:

1394040-52-8

Catalog Number:

AG01A0AB

Molecular Formula:

C9H6F4N2O2S

Molecular Weight:

282.2148

Catalog Number:

AG01A0AB

Chemical Name:

3-cyano-4-fluoro-N-(2,2,2-trifluoroethyl)benzene-1-sulfonamide

CAS Number:

1394040-52-8

Molecular Formula:

C9H6F4N2O2S

Molecular Weight:

282.2148

MDL Number:

MFCD18558064

IUPAC Name:

3-cyano-4-fluoro-N-(2,2,2-trifluoroethyl)benzenesulfonamide

InChI:

InChI=1S/C9H6F4N2O2S/c10-8-2-1-7(3-6(8)4-14)18(16,17)15-5-9(11,12)13/h1-3,15H,5H2

InChI Key:

XTMNERAQUITYOY-UHFFFAOYSA-N

SMILES:

N#Cc1cc(ccc1F)S(=O)(=O)NCC(F)(F)F

Complexity:

434

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

282.009g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

282.213g/mol

Monoisotopic Mass:

282.009g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

78.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8