ChemSpider 2D Image | 2-{[(4-Methylphenyl)sulfonyl]amino}dodecyl propionate | C22H37NO4S

2-{[(4-Methylphenyl)sulfonyl]amino}dodecyl propionate

  • Molecular FormulaC22H37NO4S
  • Average mass411.599 Da
  • Monoisotopic mass411.244324 Da
  • ChemSpider ID28591112

More details:

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

2-{[(4-Methylphenyl)sulfonyl]amino}dodecyl propionate [ACD/IUPAC Name]
2-{[(4-Methylphenyl)sulfonyl]amino}dodecylpropionat [German] [ACD/IUPAC Name]
Benzenesulfonamide, 4-methyl-N-[1-[(1-oxopropoxy)methyl]undecyl]- [ACD/Index Name]
Propionate de 2-{[(4-méthylphényl)sulfonyl]amino}dodécyle [French] [ACD/IUPAC Name]
2-(4-METHYLBENZENESULFONAMIDO)DODECYL PROPANOATE
2-(4-Methylphenylsulfonamido)dodecyl propionate
2-[(4-Methylbenzene-1-sulfonyl)amino]dodecyl propanoate
834889-13-3 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 519.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.3±3.0 kJ/mol
Flash Point: 268.2±32.9 °C
Index of Refraction: 1.500
Molar Refractivity: 115.1±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 1
ACD/LogP: 7.36
ACD/LogD (pH 5.5): 7.28
ACD/BCF (pH 5.5): 198908.84
ACD/KOC (pH 5.5): 215948.70
ACD/LogD (pH 7.4): 7.27
ACD/BCF (pH 7.4): 198690.78
ACD/KOC (pH 7.4): 215711.95
Polar Surface Area: 81 Å2
Polarizability: 45.6±0.5 10-24cm3
Surface Tension: 38.5±3.0 dyne/cm
Molar Volume: 391.3±3.0 cm3

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