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1138-53-0

1138-53-0 | 1-N-methylbenzene-1,4-disulfonamide

CAS No: 1138-53-0 Catalog No: AG01AJ2L MDL No:MFCD11204814

Product Description

Catalog Number:
AG01AJ2L
Chemical Name:
1-N-methylbenzene-1,4-disulfonamide
CAS Number:
1138-53-0
Molecular Formula:
C7H10N2O4S2
Molecular Weight:
250.2953
MDL Number:
MFCD11204814
IUPAC Name:
4-N-methylbenzene-1,4-disulfonamide
InChI:
InChI=1S/C7H10N2O4S2/c1-9-15(12,13)7-4-2-6(3-5-7)14(8,10)11/h2-5,9H,1H3,(H2,8,10,11)
InChI Key:
QWMGQMVXUZNDTO-UHFFFAOYSA-N
SMILES:
CNS(=O)(=O)c1ccc(cc1)S(=O)(=O)N

Properties

Complexity:
395  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.008g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
250.287g/mol
Monoisotopic Mass:
250.008g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
123A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  

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