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834889-12-2 | Benzenesulfonamide, N-[1-[(acetyloxy)methyl]decyl]-4-methyl-
CAS No: 834889-12-2 Catalog No: AG004VPH MDL No:
Product Description
Catalog Number:
AG004VPH
Chemical Name:
Benzenesulfonamide, N-[1-[(acetyloxy)methyl]decyl]-4-methyl-
CAS Number:
834889-12-2
Molecular Formula:
C20H33NO4S
Molecular Weight:
383.5453
IUPAC Name:
2-[(4-methylphenyl)sulfonylamino]undecyl acetate
InChI:
InChI=1S/C20H33NO4S/c1-4-5-6-7-8-9-10-11-19(16-25-18(3)22)21-26(23,24)20-14-12-17(2)13-15-20/h12-15,19,21H,4-11,16H2,1-3H3
InChI Key:
JNBUAHQHKZLUDK-UHFFFAOYSA-N
SMILES:
CCCCCCCCCC(NS(=O)(=O)c1ccc(cc1)C)COC(=O)C
Properties
Complexity:
479
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
383.213g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
383.547g/mol
Monoisotopic Mass:
383.213g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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