ChemSpider 2D Image | (2R,3S)-2,3-Disulfanyl-1,4-butanediol | C4H10O2S2

(2R,3S)-2,3-Disulfanyl-1,4-butanediol

  • Molecular FormulaC4H10O2S2
  • Average mass154.251 Da
  • Monoisotopic mass154.012222 Da
  • ChemSpider ID61597337

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R,3S)-2,3-Disulfanyl-1,4-butandiol [German] [ACD/IUPAC Name]
(2R,3S)-2,3-Disulfanyl-1,4-butanediol [ACD/IUPAC Name]
(2R,3S)-2,3-Disulfanyl-1,4-butanediol [French] [ACD/IUPAC Name]
1,4-Butanediol, 2,3-dimercapto-, (2R,3S)- [ACD/Index Name]
122844-69-3 [RN]
dithio-erythritol

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

Density: 1.3±0.1 g/cm3
Boiling Point: 300.4±21.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 62.7±6.0 kJ/mol
Flash Point: 135.5±22.1 °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: 0.08
ACD/LogD (pH 5.5): 0.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 30.47
ACD/LogD (pH 7.4): 0.19
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 29.80
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


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