Home Sulfos 3-Amino-n-(3-trifluoromethyl-phenyl)-benzenesulfonamide

3-Amino-n-(3-trifluoromethyl-phenyl)-benzenesulfonamide

CAS No.:
327093-05-0
Catalog Number:
AG00I68L
Molecular Formula:
C13H11F3N2O2S
Molecular Weight:
316.2988
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Product Description
Catalog Number:
AG00I68L
Chemical Name:
3-Amino-n-(3-trifluoromethyl-phenyl)-benzenesulfonamide
CAS Number:
327093-05-0
Molecular Formula:
C13H11F3N2O2S
Molecular Weight:
316.2988
MDL Number:
MFCD02708237
IUPAC Name:
3-amino-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide
InChI:
InChI=1S/C13H11F3N2O2S/c14-13(15,16)9-3-1-5-11(7-9)18-21(19,20)12-6-2-4-10(17)8-12/h1-8,18H,17H2
InChI Key:
LNRXTKNBQCSDLR-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)S(=O)(=O)Nc1cccc(c1)C(F)(F)F
Properties
Complexity:
447  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.049g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
316.298g/mol
Monoisotopic Mass:
316.049g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
80.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties