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22236-45-9

22236-45-9 | S,S-DIMETHYL-N-(P-TOLUENESULFONYL)SULFOXIMINE

CAS No: 22236-45-9 Catalog No: AG003U6D MDL No:MFCD00013922

Product Description

Catalog Number:
AG003U6D
Chemical Name:
S,S-DIMETHYL-N-(P-TOLUENESULFONYL)SULFOXIMINE
CAS Number:
22236-45-9
Molecular Formula:
C9H13NO3S2
Molecular Weight:
247.3344
MDL Number:
MFCD00013922
IUPAC Name:
N-[dimethyl(oxo)-λ6-sulfanylidene]-4-methylbenzenesulfonamide
InChI:
InChI=1S/C9H13NO3S2/c1-8-4-6-9(7-5-8)15(12,13)10-14(2,3)11/h4-7H,1-3H3
InChI Key:
IRNAWARRPQUZDU-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)N=S(=O)(C)C
EC Number:
244-861-2
NSC Number:
202395

Properties

Complexity:
411  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.034g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.327g/mol
Monoisotopic Mass:
247.034g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
80.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  

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