ChemSpider 2D Image | Undecyl 2-[(2,4-dichlorophenyl)amino]-4,4-dimethyl-6-oxo-1-cyclohexene-1-carbodithioate | C26H37Cl2NOS2

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

  • Molecular FormulaC26H37Cl2NOS2
  • Average mass514.614 Da
  • Monoisotopic mass513.169373 Da
  • ChemSpider ID24741804

More details:

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

1-Cyclohexene-1-carbodithioic acid, 2-[(2,4-dichlorophenyl)amino]-4,4-dimethyl-6-oxo-, undecyl ester [ACD/Index Name]
2-[(2,4-Dichlorophényl)amino]-4,4-diméthyl-6-oxo-1-cyclohexène-1-carbodithioate d'undécyle [French] [ACD/IUPAC Name]
Undecyl 2-[(2,4-dichlorophenyl)amino]-4,4-dimethyl-6-oxo-1-cyclohexene-1-carbodithioate [ACD/IUPAC Name]
Undecyl-2-[(2,4-dichlorphenyl)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: 1.2±0.1 g/cm3
Boiling Point: 580.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.8±3.0 kJ/mol
Flash Point: 304.9±32.9 °C
Index of Refraction: 1.584
Molar Refractivity: 146.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 10.61
ACD/LogD (pH 5.5): 10.40
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 10.40
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 86 Å2
Polarizability: 58.1±0.5 10-24cm3
Surface Tension: 49.1±3.0 dyne/cm
Molar Volume: 437.6±3.0 cm3

Click to predict properties on the Chemicalize site


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