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Home > Sulfanilamide > 114097-27-7
114097-27-7 | N-(3,4-dimethylphenyl)-4-methylbenzenesulfonamide
CAS No: 114097-27-7 Catalog No: AG00HCRQ MDL No:MFCD01181378
Product Description
Catalog Number:
AG00HCRQ
Chemical Name:
N-(3,4-dimethylphenyl)-4-methylbenzenesulfonamide
CAS Number:
114097-27-7
Molecular Formula:
C15H17NO2S
Molecular Weight:
275.3660
MDL Number:
MFCD01181378
IUPAC Name:
N-(3,4-dimethylphenyl)-4-methylbenzenesulfonamide
InChI:
InChI=1S/C15H17NO2S/c1-11-4-8-15(9-5-11)19(17,18)16-14-7-6-12(2)13(3)10-14/h4-10,16H,1-3H3
InChI Key:
NQUKYTXPMUKVOZ-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)Nc1ccc(c(c1)C)C
Properties
Complexity:
379
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.098g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
275.366g/mol
Monoisotopic Mass:
275.098g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
Literature
| Title | Journal |
|---|---|
| N-(3,4-Dimethyl-phen-yl)-4-methyl-benzene-sulfonamide. | Acta crystallographica. Section E, Structure reports online 20090401 |
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