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824403-04-5 | Benzenesulfonamide, N-(2-butyl-2-cyclohexen-1-yl)-4-methyl-
CAS No: 824403-04-5 Catalog No: AG004WAP MDL No:
Product Description
Catalog Number:
AG004WAP
Chemical Name:
Benzenesulfonamide, N-(2-butyl-2-cyclohexen-1-yl)-4-methyl-
CAS Number:
824403-04-5
Molecular Formula:
C17H25NO2S
Molecular Weight:
307.4509
IUPAC Name:
N-(2-butylcyclohex-2-en-1-yl)-4-methylbenzenesulfonamide
InChI:
InChI=1S/C17H25NO2S/c1-3-4-7-15-8-5-6-9-17(15)18-21(19,20)16-12-10-14(2)11-13-16/h8,10-13,17-18H,3-7,9H2,1-2H3
InChI Key:
GXMYQJWAEWEEQF-UHFFFAOYSA-N
SMILES:
CCCCC1=CCCCC1NS(=O)(=O)c1ccc(cc1)C
Properties
Complexity:
442
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.161g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
307.452g/mol
Monoisotopic Mass:
307.161g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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