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88971-52-2 | Benzenesulfonamide, N,3-diethyl-4-[[(trifluoromethyl)sulfonyl]amino]-
CAS No: 88971-52-2 Catalog No: AG0046VC MDL No:
Product Description
Catalog Number:
AG0046VC
Chemical Name:
Benzenesulfonamide, N,3-diethyl-4-[[(trifluoromethyl)sulfonyl]amino]-
CAS Number:
88971-52-2
Molecular Formula:
C11H15F3N2O4S2
Molecular Weight:
360.3730
IUPAC Name:
N,3-diethyl-4-(trifluoromethylsulfonylamino)benzenesulfonamide
InChI:
InChI=1S/C11H15F3N2O4S2/c1-3-8-7-9(21(17,18)15-4-2)5-6-10(8)16-22(19,20)11(12,13)14/h5-7,15-16H,3-4H2,1-2H3
InChI Key:
GNPZLYQKAQTJRM-UHFFFAOYSA-N
SMILES:
CCNS(=O)(=O)c1ccc(c(c1)CC)NS(=O)(=O)C(F)(F)F
Properties
Complexity:
564
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
360.043g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
360.366g/mol
Monoisotopic Mass:
360.043g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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