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89784-46-3

89784-46-3 | Benzenesulfonamide, 4-(1,1-dimethylethyl)-N-(1,1,3,3-tetramethylbutyl)-

CAS No: 89784-46-3 Catalog No: AG003YHN MDL No:

Product Description

Catalog Number:
AG003YHN
Chemical Name:
Benzenesulfonamide, 4-(1,1-dimethylethyl)-N-(1,1,3,3-tetramethylbutyl)-
CAS Number:
89784-46-3
Molecular Formula:
C18H31NO2S
Molecular Weight:
325.5092
IUPAC Name:
4-tert-butyl-N-(2,4,4-trimethylpentan-2-yl)benzenesulfonamide
InChI:
InChI=1S/C18H31NO2S/c1-16(2,3)13-18(7,8)19-22(20,21)15-11-9-14(10-12-15)17(4,5)6/h9-12,19H,13H2,1-8H3
InChI Key:
VUBCLDCZMWYUIR-UHFFFAOYSA-N
SMILES:
CC(CC(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)(C)C)(C)C

Properties

Complexity:
453  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.208g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
325.511g/mol
Monoisotopic Mass:
325.208g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3  

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