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Home > Sulfanilamide > 7467-12-1
7467-12-1 | Benzenesulfonamide, 2,4-dimethyl- (9CI)
CAS No: 7467-12-1 Catalog No: AG00FD29 MDL No:MFCD00460793
Product Description
Catalog Number:
AG00FD29
Chemical Name:
Benzenesulfonamide, 2,4-dimethyl- (9CI)
CAS Number:
7467-12-1
Molecular Formula:
C8H11NO2S
Molecular Weight:
185.2434
MDL Number:
MFCD00460793
IUPAC Name:
2,4-dimethylbenzenesulfonamide
InChI:
InChI=1S/C8H11NO2S/c1-6-3-4-8(7(2)5-6)12(9,10)11/h3-5H,1-2H3,(H2,9,10,11)
InChI Key:
UGBKWMBOBQOCSS-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)C)S(=O)(=O)N
EC Number:
231-261-0
NSC Number:
400648
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.051g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
185.241g/mol
Monoisotopic Mass:
185.051g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Literature
| Title | Journal |
|---|---|
| N-(4-Chloro-phen-yl)-2,4-dimethyl-benzene-sulfonamide. | Acta crystallographica. Section E, Structure reports online 20110801 |
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