ChemSpider 2D Image | 4-[Hexadecyl(vinylsulfonyl)amino]-2-methylbenzenesulfonic acid | C25H43NO5S2

4-[Hexadecyl(vinylsulfonyl)amino]-2-methylbenzenesulfonic acid

  • Molecular FormulaC25H43NO5S2
  • Average mass501.743 Da
  • Monoisotopic mass501.258270 Da
  • ChemSpider ID102617566

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

4-[Hexadecyl(vinylsulfonyl)amino]-2-methylbenzenesulfonic acid [ACD/IUPAC Name]
4-[Hexadecyl(vinylsulfonyl)amino]-2-methylbenzolsulfonsäure [German] [ACD/IUPAC Name]
Acide 4-[hexadécyl(vinylsulfonyl)amino]-2-méthylbenzènesulfonique [French] [ACD/IUPAC Name]
Benzenesulfonic acid, 4-[(ethenylsulfonyl)hexadecylamino]-2-methyl- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.528
Molar Refractivity: 137.5±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 2
ACD/LogP: 8.37
ACD/LogD (pH 5.5): 3.92
ACD/BCF (pH 5.5): 80.99
ACD/KOC (pH 5.5): 81.87
ACD/LogD (pH 7.4): 3.92
ACD/BCF (pH 7.4): 80.86
ACD/KOC (pH 7.4): 81.74
Polar Surface Area: 109 Å2
Polarizability: 54.5±0.5 10-24cm3
Surface Tension: 44.4±3.0 dyne/cm
Molar Volume: 446.7±3.0 cm3

Click to predict properties on the Chemicalize site


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