ChemSpider 2D Image | (2Z)-3-[(2,2-Dihydroxyvinyl)sulfanyl]-2-hydroxyacrylic acid | C5H6O5S

(2Z)-3-[(2,2-Dihydroxyvinyl)sulfanyl]-2-hydroxyacrylic acid

  • Molecular FormulaC5H6O5S
  • Average mass178.163 Da
  • Monoisotopic mass177.993591 Da
  • ChemSpider ID95553036

More details:

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

(2Z)-3-[(2,2-Dihydroxyvinyl)sulfanyl]-2-hydroxyacrylic acid [ACD/IUPAC Name]
(2Z)-3-[(2,2-Dihydroxyvinyl)sulfanyl]-2-hydroxyacrylsäure [German] [ACD/IUPAC Name]
2-Propenoic acid, 3-[(2,2-dihydroxyethenyl)thio]-2-hydroxy-, (2Z)- [ACD/Index Name]
Acide (2Z)-3-[(2,2-dihydroxyvinyl)sulfanyl]-2-hydroxyacrylique [French] [ACD/IUPAC Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 397.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 74.8±6.0 kJ/mol
Flash Point: 193.9±27.9 °C
Index of Refraction: 1.722
Molar Refractivity: 39.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.69
ACD/LogD (pH 5.5): -3.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.47
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 123 Å2
Polarizability: 15.5±0.5 10-24cm3
Surface Tension: 109.8±3.0 dyne/cm
Molar Volume: 99.0±3.0 cm3

Click to predict properties on the Chemicalize site


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