ChemSpider 2D Image | O,O-Diisopropyl (mesitylcarbamothioyl)phosphoramidothioate | C16H27N2O2PS2

O,O-Diisopropyl (mesitylcarbamothioyl)phosphoramidothioate

  • Molecular FormulaC16H27N2O2PS2
  • Average mass374.501 Da
  • Monoisotopic mass374.125153 Da
  • ChemSpider ID30652802

More details:

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

(Mésitylcarbamothioyl)phosphoramidothioate de O,O-diisopropyle [French] [ACD/IUPAC Name]
O,O-Diisopropyl (mesitylcarbamothioyl)phosphoramidothioate [ACD/IUPAC Name]
O,O-Diisopropyl-(mesitylcarbamothioyl)phosphoramidothioat [German] [ACD/IUPAC Name]
Phosphoramidothioic acid, N-[thioxo[(2,4,6-trimethylphenyl)amino]methyl]-, O,O-bis(1-methylethyl) ester [ACD/Index 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: 423.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.8±3.0 kJ/mol
Flash Point: 210.1±31.5 °C
Index of Refraction: 1.589
Molar Refractivity: 106.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.50
ACD/LogD (pH 5.5): 4.69
ACD/BCF (pH 5.5): 2149.44
ACD/KOC (pH 5.5): 8448.87
ACD/LogD (pH 7.4): 4.67
ACD/BCF (pH 7.4): 2049.73
ACD/KOC (pH 7.4): 8056.94
Polar Surface Area: 117 Å2
Polarizability: 42.2±0.5 10-24cm3
Surface Tension: 49.9±3.0 dyne/cm
Molar Volume: 316.1±3.0 cm3

Click to predict properties on the Chemicalize site


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