ChemSpider 2D Image | O,O-Dimethyl (1-aminoethyl)phosphonothioate | C4H12NO2PS

O,O-Dimethyl (1-aminoethyl)phosphonothioate

  • Molecular FormulaC4H12NO2PS
  • Average mass169.182 Da
  • Monoisotopic mass169.032639 Da
  • ChemSpider ID60618127

More details:

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

(1-Aminoéthyl)phosphonothioate de O,O-diméthyle [French] [ACD/IUPAC Name]
O,O-Dimethyl (1-aminoethyl)phosphonothioate [ACD/IUPAC Name]
O,O-Dimethyl-(1-aminoethyl)phosphonothioat [German] [ACD/IUPAC Name]
Phosphonothioic acid, P-(1-aminoethyl)-, O,O-dimethyl ester [ACD/Index Name]
146036-86-4 [RN]
MFCD20716123

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

Density: 1.2±0.1 g/cm3
Boiling Point: 187.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.6±0.4 mmHg at 25°C
Enthalpy of Vaporization: 42.3±3.0 kJ/mol
Flash Point: 66.9±27.9 °C
Index of Refraction: 1.493
Molar Refractivity: 41.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.68
ACD/LogD (pH 5.5): -1.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 28.30
Polar Surface Area: 86 Å2
Polarizability: 16.5±0.5 10-24cm3
Surface Tension: 44.7±3.0 dyne/cm
Molar Volume: 143.4±3.0 cm3

Click to predict properties on the Chemicalize site


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