Home Sulfos 2-nitro-4-(trifluoromethyl)benzenesulfonamide

2-nitro-4-(trifluoromethyl)benzenesulfonamide

CAS No.:
577-61-7
Catalog Number:
AG00EZJ7
Molecular Formula:
C7H5F3N2O4S
Molecular Weight:
270.1858
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Product Description
Catalog Number:
AG00EZJ7
Chemical Name:
2-nitro-4-(trifluoromethyl)benzenesulfonamide
CAS Number:
577-61-7
Molecular Formula:
C7H5F3N2O4S
Molecular Weight:
270.1858
MDL Number:
MFCD00013462
IUPAC Name:
2-nitro-4-(trifluoromethyl)benzenesulfonamide
InChI:
InChI=1S/C7H5F3N2O4S/c8-7(9,10)4-1-2-6(17(11,15)16)5(3-4)12(13)14/h1-3H,(H2,11,15,16)
InChI Key:
GCJFIVMGFRULPF-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1S(=O)(=O)N)C(F)(F)F
Properties
Complexity:
397  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.992g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
270.182g/mol
Monoisotopic Mass:
269.992g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties