ChemSpider 2D Image | [Phenyl(sulfanyl)phosphoryl]acetic acid | C8H9O3PS

[Phenyl(sulfanyl)phosphoryl]acetic acid

  • Molecular FormulaC8H9O3PS
  • Average mass216.194 Da
  • Monoisotopic mass216.001007 Da
  • ChemSpider ID60643117

More details:

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

[Phenyl(sulfanyl)phosphoryl]acetic acid [ACD/IUPAC Name]
[Phenyl(sulfanyl)phosphoryl]essigsäure [German] [ACD/IUPAC Name]
Acetic acid, 2-(mercaptophenylphosphinyl)- [ACD/Index Name]
Acide [phényl(sulfanyl)phosphoryl]acétique [French] [ACD/IUPAC Name]
1824463-72-0 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 383.4±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 66.7±3.0 kJ/mol
Flash Point: 185.7±28.4 °C
Index of Refraction: 1.575
Molar Refractivity: 52.3±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.54
ACD/LogD (pH 5.5): -2.90
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.93
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 103 Å2
Polarizability: 20.7±0.5 10-24cm3
Surface Tension: 54.9±5.0 dyne/cm
Molar Volume: 158.0±5.0 cm3

Click to predict properties on the Chemicalize site


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