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95339-74-5 | Benzeneethanesulfonamide, N-methyl-
CAS No: 95339-74-5 Catalog No: AG00659C MDL No:
Product Description
Catalog Number:
AG00659C
Chemical Name:
Benzeneethanesulfonamide, N-methyl-
CAS Number:
95339-74-5
Molecular Formula:
C9H13NO2S
Molecular Weight:
199.2700
IUPAC Name:
N-methyl-2-phenylethanesulfonamide
InChI:
InChI=1S/C9H13NO2S/c1-10-13(11,12)8-7-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3
InChI Key:
SRESMQYZCCSHOY-UHFFFAOYSA-N
SMILES:
CNS(=O)(=O)CCc1ccccc1
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.067g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
199.268g/mol
Monoisotopic Mass:
199.067g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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