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824403-09-0 | Benzenesulfonamide, N-(1,2-dimethyl-2-cyclohexen-1-yl)-4-methyl-
CAS No: 824403-09-0 Catalog No: AG004WAO MDL No:
Product Description
Catalog Number:
AG004WAO
Chemical Name:
Benzenesulfonamide, N-(1,2-dimethyl-2-cyclohexen-1-yl)-4-methyl-
CAS Number:
824403-09-0
Molecular Formula:
C15H21NO2S
Molecular Weight:
279.3977
IUPAC Name:
N-(1,2-dimethylcyclohex-2-en-1-yl)-4-methylbenzenesulfonamide
InChI:
InChI=1S/C15H21NO2S/c1-12-7-9-14(10-8-12)19(17,18)16-15(3)11-5-4-6-13(15)2/h6-10,16H,4-5,11H2,1-3H3
InChI Key:
DIWKOCGAKXDSNK-UHFFFAOYSA-N
SMILES:
CC1=CCCCC1(C)NS(=O)(=O)c1ccc(cc1)C
Properties
Complexity:
441
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.129g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
279.398g/mol
Monoisotopic Mass:
279.129g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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