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949321-46-4 | 1-N-cyclohexyl-1-N-methylbenzene-1,2-disulfonamide
CAS No: 949321-46-4 Catalog No: AG019KY1 MDL No:MFCD09802110
Product Description
Catalog Number:
AG019KY1
Chemical Name:
1-N-cyclohexyl-1-N-methylbenzene-1,2-disulfonamide
CAS Number:
949321-46-4
Molecular Formula:
C13H20N2O4S2
Molecular Weight:
332.4389
MDL Number:
MFCD09802110
IUPAC Name:
2-N-cyclohexyl-2-N-methylbenzene-1,2-disulfonamide
InChI:
InChI=1S/C13H20N2O4S2/c1-15(11-7-3-2-4-8-11)21(18,19)13-10-6-5-9-12(13)20(14,16)17/h5-6,9-11H,2-4,7-8H2,1H3,(H2,14,16,17)
InChI Key:
AAUVVCHGNHSEJG-UHFFFAOYSA-N
SMILES:
CN(S(=O)(=O)c1ccccc1S(=O)(=O)N)C1CCCCC1
Properties
Complexity:
542
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
332.086g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
332.433g/mol
Monoisotopic Mass:
332.086g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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