ChemSpider 2D Image | 1,4-Disulfanyl-2,3-butanediol | C4H10O2S2

1,4-Disulfanyl-2,3-butanediol

  • Molecular FormulaC4H10O2S2
  • Average mass154.251 Da
  • Monoisotopic mass154.012222 Da
  • ChemSpider ID21436130

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

1,4-Disulfanyl-2,3-butandiol [German] [ACD/IUPAC Name]
1,4-Disulfanyl-2,3-butanediol [ACD/IUPAC Name]
1,4-Disulfanyl-2,3-butanediol [French] [ACD/IUPAC Name]
2,3-Butanediol, 1,4-dimercapto- [ACD/Index Name]
D-8220

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

Density: 1.3±0.1 g/cm3
Boiling Point: 364.5±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 70.7±6.0 kJ/mol
Flash Point: 174.2±27.9 °C
Index of Refraction: 1.579
Molar Refractivity: 39.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.07
ACD/LogD (pH 5.5): 0.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 25.53
ACD/LogD (pH 7.4): 0.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 25.21
Polar Surface Area: 118 Å2
Polarizability: 15.6±0.5 10-24cm3
Surface Tension: 55.5±3.0 dyne/cm
Molar Volume: 118.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement