ChemSpider 2D Image | Undecyl 2-[(4-chlorophenyl)amino]-4,4-dimethyl-6-oxo-1-cyclohexene-1-carbodithioate | C26H38ClNOS2

Undecyl 2-[(4-chlorophenyl)amino]-4,4-dimethyl-6-oxo-1-cyclohexene-1-carbodithioate

  • Molecular FormulaC26H38ClNOS2
  • Average mass480.169 Da
  • Monoisotopic mass479.208344 Da
  • ChemSpider ID24741802

More details:

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

1-Cyclohexene-1-carbodithioic acid, 2-[(4-chlorophenyl)amino]-4,4-dimethyl-6-oxo-, undecyl ester [ACD/Index Name]
2-[(4-Chlorophényl)amino]-4,4-diméthyl-6-oxo-1-cyclohexène-1-carbodithioate d'undécyle [French] [ACD/IUPAC Name]
Undecyl 2-[(4-chlorophenyl)amino]-4,4-dimethyl-6-oxo-1-cyclohexene-1-carbodithioate [ACD/IUPAC Name]
Undecyl-2-[(4-chlorphenyl)amino]-4,4-dimethyl-6-oxo-1-cyclohexen-1-carbodithioat [German] [ACD/IUPAC 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: 565.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.9±3.0 kJ/mol
Flash Point: 295.7±32.9 °C
Index of Refraction: 1.580
Molar Refractivity: 141.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 1
ACD/LogP: 10.09
ACD/LogD (pH 5.5): 9.82
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 5246464.50
ACD/LogD (pH 7.4): 9.82
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 5246464.50
Polar Surface Area: 86 Å2
Polarizability: 56.1±0.5 10-24cm3
Surface Tension: 48.2±3.0 dyne/cm
Molar Volume: 425.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement