ChemSpider 2D Image | 4-[Hexadecyl(1-methoxy-1-oxo-2-propanyl)amino]benzenesulfonic acid | C26H45NO5S

4-[Hexadecyl(1-methoxy-1-oxo-2-propanyl)amino]benzenesulfonic acid

  • Molecular FormulaC26H45NO5S
  • Average mass483.704 Da
  • Monoisotopic mass483.301849 Da
  • ChemSpider ID103508215

More details:

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

4-[Hexadecyl(1-methoxy-1-oxo-2-propanyl)amino]benzenesulfonic acid [ACD/IUPAC Name]
4-[Hexadecyl(1-methoxy-1-oxo-2-propanyl)amino]benzolsulfonsäure [German] [ACD/IUPAC Name]
Acide 4-[hexadécyl(1-méthoxy-1-oxo-2-propanyl)amino]benzènesulfonique [French] [ACD/IUPAC Name]
Alanine, N-hexadecyl-N-(4-sulfophenyl)-, methyl ester [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.512
Molar Refractivity: 135.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 1
ACD/LogP: 8.88
ACD/LogD (pH 5.5): 4.16
ACD/BCF (pH 5.5): 123.79
ACD/KOC (pH 5.5): 111.63
ACD/LogD (pH 7.4): 4.15
ACD/BCF (pH 7.4): 120.89
ACD/KOC (pH 7.4): 109.01
Polar Surface Area: 92 Å2
Polarizability: 53.7±0.5 10-24cm3
Surface Tension: 42.2±3.0 dyne/cm
Molar Volume: 451.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement