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Home > Sulfanilamide > 717-44-2
717-44-2 | 4-METHYL-1,3-BENZENEDISULFONAMIDE
CAS No: 717-44-2 Catalog No: AG01B2UR MDL No:MFCD01203035
Product Description
Catalog Number:
AG01B2UR
Chemical Name:
4-METHYL-1,3-BENZENEDISULFONAMIDE
CAS Number:
717-44-2
Molecular Formula:
C7H10N2O4S2
Molecular Weight:
250.2953
MDL Number:
MFCD01203035
IUPAC Name:
4-methylbenzene-1,3-disulfonamide
InChI:
InChI=1S/C7H10N2O4S2/c1-5-2-3-6(14(8,10)11)4-7(5)15(9,12)13/h2-4H,1H3,(H2,8,10,11)(H2,9,12,13)
InChI Key:
WNBQNPLPWYPVCU-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1S(=O)(=O)N)S(=O)(=O)N
UNII:
5674UBC61A
NSC Number:
49754
Properties
Complexity:
417
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:
2
Topological Polar Surface Area:
137A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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