ChemSpider 2D Image | S-{2-[(2-Hydroxy-2-propen-1-yl)amino]ethyl} dihydrogen phosphorothioate | C5H12NO4PS

S-{2-[(2-Hydroxy-2-propen-1-yl)amino]ethyl} dihydrogen phosphorothioate

  • Molecular FormulaC5H12NO4PS
  • Average mass213.192 Da
  • Monoisotopic mass213.022461 Da
  • ChemSpider ID95745304

More details:

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

1-Propen-2-ol, 3-[[2-(phosphonothio)ethyl]amino]- [ACD/Index Name]
Dihydrogénophosphorothioate de S-{2-[(2-hydroxy-2-propén-1-yl)amino]éthyle} [French] [ACD/IUPAC Name]
S-{2-[(2-Hydroxy-2-propen-1-yl)amino]ethyl} dihydrogen phosphorothioate [ACD/IUPAC Name]
S-{2-[(2-Hydroxy-2-propen-1-yl)amino]ethyl}dihydrogenphosphorothioat [German] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 483.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 81.9±6.0 kJ/mol
Flash Point: 246.0±31.5 °C
Index of Refraction: 1.572
Molar Refractivity: 47.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.73
ACD/LogD (pH 5.5): -3.99
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.46
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 125 Å2
Polarizability: 19.0±0.5 10-24cm3
Surface Tension: 67.7±3.0 dyne/cm
Molar Volume: 145.4±3.0 cm3

Click to predict properties on the Chemicalize site


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