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235100-91-1 | Methanesulfonamide, N-(2-cyanophenyl)-N-(methylsulfonyl)-
CAS No: 235100-91-1 Catalog No: AG002NHA MDL No:MFCD01648439
Product Description
Catalog Number:
AG002NHA
Chemical Name:
Methanesulfonamide, N-(2-cyanophenyl)-N-(methylsulfonyl)-
CAS Number:
235100-91-1
Molecular Formula:
C9H10N2O4S2
Molecular Weight:
274.3167
MDL Number:
MFCD01648439
IUPAC Name:
N-(2-cyanophenyl)-N-methylsulfonylmethanesulfonamide
InChI:
InChI=1S/C9H10N2O4S2/c1-16(12,13)11(17(2,14)15)9-6-4-3-5-8(9)7-10/h3-6H,1-2H3
InChI Key:
WQIXEXYWRAYERZ-UHFFFAOYSA-N
SMILES:
N#Cc1ccccc1N(S(=O)(=O)C)S(=O)(=O)C
Properties
Complexity:
486
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.008g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.309g/mol
Monoisotopic Mass:
274.008g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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