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4703-15-5 | N-(2,6-dimethylphenyl)-4-methylbenzenesulfonamide
CAS No: 4703-15-5 Catalog No: AG00DIRF MDL No:MFCD00185176
Product Description
Catalog Number:
AG00DIRF
Chemical Name:
N-(2,6-dimethylphenyl)-4-methylbenzenesulfonamide
CAS Number:
4703-15-5
Molecular Formula:
C15H17NO2S
Molecular Weight:
275.3660
MDL Number:
MFCD00185176
IUPAC Name:
N-(2,6-dimethylphenyl)-4-methylbenzenesulfonamide
InChI:
InChI=1S/C15H17NO2S/c1-11-7-9-14(10-8-11)19(17,18)16-15-12(2)5-4-6-13(15)3/h4-10,16H,1-3H3
InChI Key:
SEYRJIDJWCOIBS-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1NS(=O)(=O)c1ccc(cc1)C)C
NSC Number:
97146
Properties
Complexity:
369
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-(2,6-Dimethyl-phen-yl)-4-methyl-benzene-sulfonamide. | Acta crystallographica. Section E, Structure reports online 20100501 |
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