Name: Name:4-{[(2,2,2-trifluoroethyl)sulfamoyl]amino}benzoic acid
Brand: Angene
SKU: AG01AG2W
Rating: 90 (10 reviews)

4-{[(2,2,2-trifluoroethyl)sulfamoyl]amino}benzoic acid

CAS No.:

1712169-32-8

Catalog Number:

AG01AG2W

Molecular Formula:

C9H9F3N2O4S

Molecular Weight:

298.2390

Catalog Number:

AG01AG2W

Chemical Name:

4-{[(2,2,2-trifluoroethyl)sulfamoyl]amino}benzoic acid

CAS Number:

1712169-32-8

Molecular Formula:

C9H9F3N2O4S

Molecular Weight:

298.2390

MDL Number:

MFCD27920324

IUPAC Name:

4-(2,2,2-trifluoroethylsulfamoylamino)benzoic acid

InChI:

InChI=1S/C9H9F3N2O4S/c10-9(11,12)5-13-19(17,18)14-7-3-1-6(2-4-7)8(15)16/h1-4,13-14H,5H2,(H,15,16)

InChI Key:

HKGKSKSQILDHFY-UHFFFAOYSA-N

SMILES:

OC(=O)c1ccc(cc1)NS(=O)(=O)NCC(F)(F)F

Complexity:

410

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

298.024g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

298.236g/mol

Monoisotopic Mass:

298.024g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

104A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3