ChemSpider 2D Image | Dimethyl [anilino(1,3-thiazol-2-yl)methyl]phosphonate | C12H15N2O3PS

Dimethyl [anilino(1,3-thiazol-2-yl)methyl]phosphonate

  • Molecular FormulaC12H15N2O3PS
  • Average mass298.298 Da
  • Monoisotopic mass298.054108 Da
  • ChemSpider ID57603732

More details:

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

[Anilino(1,3-thiazol-2-yl)méthyl]phosphonate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl [anilino(1,3-thiazol-2-yl)methyl]phosphonate [ACD/IUPAC Name]
Dimethyl-[anilino(1,3-thiazol-2-yl)methyl]phosphonat [German] [ACD/IUPAC Name]
Phosphonic acid, P-[(phenylamino)-2-thiazolylmethyl]-, dimethyl ester [ACD/Index Name]
1262553-00-3 [RN]
dimethyl [(phenylamino)(1,3-thiazol-2-yl)methyl]phosphonate

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

Density: 1.3±0.1 g/cm3
Boiling Point: 455.9±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.6±3.0 kJ/mol
Flash Point: 229.5±27.3 °C
Index of Refraction: 1.602
Molar Refractivity: 76.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.91
ACD/LogD (pH 5.5): 1.84
ACD/BCF (pH 5.5): 14.81
ACD/KOC (pH 5.5): 239.54
ACD/LogD (pH 7.4): 1.84
ACD/BCF (pH 7.4): 14.81
ACD/KOC (pH 7.4): 239.58
Polar Surface Area: 99 Å2
Polarizability: 30.3±0.5 10-24cm3
Surface Tension: 54.4±3.0 dyne/cm
Molar Volume: 222.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement