ChemSpider 2D Image | (2Z)-2-Hydroxy-3-(methylsulfanyl)acrylic acid | C4H6O3S

(2Z)-2-Hydroxy-3-(methylsulfanyl)acrylic acid

  • Molecular FormulaC4H6O3S
  • Average mass134.154 Da
  • Monoisotopic mass134.003769 Da
  • ChemSpider ID25057042

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-2-Hydroxy-3-(methylsulfanyl)acrylic acid [ACD/IUPAC Name]
(2Z)-2-Hydroxy-3-(methylsulfanyl)acrylsäure [German] [ACD/IUPAC Name]
(2Z)-2-hydroxy-3-(methylsulfanyl)prop-2-enoic acid
2-Propenoic acid, 2-hydroxy-3-(methylthio)-, (2Z)- [ACD/Index Name]
Acide (2Z)-2-hydroxy-3-(méthylsulfanyl)acrylique [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 295.5±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 62.1±6.0 kJ/mol
Flash Point: 132.5±27.3 °C
Index of Refraction: 1.586
Molar Refractivity: 31.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.48
ACD/LogD (pH 5.5): -1.61
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.36
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 83 Å2
Polarizability: 12.5±0.5 10-24cm3
Surface Tension: 61.9±3.0 dyne/cm
Molar Volume: 94.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement