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95106-72-2 | Benzenesulfonamide, N-(2,2-dimethyl-4-pentenyl)-4-methyl-
CAS No: 95106-72-2 Catalog No: AG006PT9 MDL No:
Product Description
Catalog Number:
AG006PT9
Chemical Name:
Benzenesulfonamide, N-(2,2-dimethyl-4-pentenyl)-4-methyl-
CAS Number:
95106-72-2
Molecular Formula:
C14H21NO2S
Molecular Weight:
267.3870
IUPAC Name:
N-(2,2-dimethylpent-4-enyl)-4-methylbenzenesulfonamide
InChI:
InChI=1S/C14H21NO2S/c1-5-10-14(3,4)11-15-18(16,17)13-8-6-12(2)7-9-13/h5-9,15H,1,10-11H2,2-4H3
InChI Key:
BOIHBDKGAOJPHZ-UHFFFAOYSA-N
SMILES:
C=CCC(CNS(=O)(=O)c1ccc(cc1)C)(C)C
Properties
Complexity:
360
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.129g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
267.387g/mol
Monoisotopic Mass:
267.129g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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