ChemSpider 2D Image | dithiocarboxysulfanyl propionic acid | C4H6O2S3

dithiocarboxysulfanyl propionic acid

  • Molecular FormulaC4H6O2S3
  • Average mass182.284 Da
  • Monoisotopic mass181.952988 Da
  • ChemSpider ID25940002

More details:

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

2-[(Sulfanylcarbonothioyl)sulfanyl]propanoic acid [ACD/IUPAC Name]
2-[(Sulfanylcarbonothioyl)sulfanyl]propansäure [German] [ACD/IUPAC Name]
Acide 2-[(sulfanylcarbonothioyl)sulfanyl]propanoïque [French] [ACD/IUPAC Name]
dithiocarboxysulfanyl propionic acid
Propanoic acid, 2-[(mercaptothioxomethyl)thio]- [ACD/Index 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: 305.8±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 60.1±6.0 kJ/mol
Flash Point: 138.8±28.4 °C
Index of Refraction: 1.661
Molar Refractivity: 45.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.98
ACD/LogD (pH 5.5): -3.23
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 133 Å2
Polarizability: 18.0±0.5 10-24cm3
Surface Tension: 74.0±3.0 dyne/cm
Molar Volume: 122.6±3.0 cm3

Click to predict properties on the Chemicalize site


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