ChemSpider 2D Image | Diethyl [(4S)-4-methyl-1,3-dithiolan-2-ylidene]phosphoramidate | C8H16NO3PS2

Diethyl [(4S)-4-methyl-1,3-dithiolan-2-ylidene]phosphoramidate

  • Molecular FormulaC8H16NO3PS2
  • Average mass269.321 Da
  • Monoisotopic mass269.030914 Da
  • ChemSpider ID34992804

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

[(4S)-4-Méthyl-1,3-dithiolan-2-ylidène]phosphoramidate de diéthyle [French] [ACD/IUPAC Name]
Diethyl [(4S)-4-methyl-1,3-dithiolan-2-ylidene]phosphoramidate [ACD/IUPAC Name]
Diethyl-[(4S)-4-methyl-1,3-dithiolan-2-yliden]phosphoramidat [German] [ACD/IUPAC Name]
Phosphoramidic acid, N-[(4S)-4-methyl-1,3-dithiolan-2-ylidene]-, diethyl ester [ACD/Index Name]
213-447-3 [EINECS]
950-10-7 [RN]
Mephosfolan [BSI] [ISO]
UNII-OE5S7E3U0H

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

Density: 1.4±0.1 g/cm3
Boiling Point: 345.6±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.6±3.0 kJ/mol
Flash Point: 162.8±23.2 °C
Index of Refraction: 1.587
Molar Refractivity: 65.5±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.48
ACD/LogD (pH 5.5): 1.57
ACD/BCF (pH 5.5): 9.22
ACD/KOC (pH 5.5): 170.69
ACD/LogD (pH 7.4): 1.57
ACD/BCF (pH 7.4): 9.22
ACD/KOC (pH 7.4): 170.69
Polar Surface Area: 108 Å2
Polarizability: 26.0±0.5 10-24cm3
Surface Tension: 51.2±7.0 dyne/cm
Molar Volume: 194.7±7.0 cm3

Click to predict properties on the Chemicalize site


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