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1141-93-1 | Benzenesulfonamide, 4-hexyl-
CAS No: 1141-93-1 Catalog No: AG000AL2 MDL No:
Product Description
Catalog Number:
AG000AL2
Chemical Name:
Benzenesulfonamide, 4-hexyl-
CAS Number:
1141-93-1
Molecular Formula:
C12H19NO2S
Molecular Weight:
241.3498
IUPAC Name:
4-hexylbenzenesulfonamide
InChI:
InChI=1S/C12H19NO2S/c1-2-3-4-5-6-11-7-9-12(10-8-11)16(13,14)15/h7-10H,2-6H2,1H3,(H2,13,14,15)
InChI Key:
QGCVBPONRAFDHS-UHFFFAOYSA-N
SMILES:
CCCCCCc1ccc(cc1)S(=O)(=O)N
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.114g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
241.349g/mol
Monoisotopic Mass:
241.114g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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