ChemSpider 2D Image | (2S,3S)-2,3-Butanedithiol | C4H10S2

(2S,3S)-2,3-Butanedithiol

  • Molecular FormulaC4H10S2
  • Average mass122.252 Da
  • Monoisotopic mass122.022392 Da
  • ChemSpider ID34986093

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S,3S)-2,3-Butandithiol [German] [ACD/IUPAC Name]
(2S,3S)-2,3-Butanedithiol [ACD/IUPAC Name]
(2S,3S)-2,3-Butanedithiol [French] [ACD/IUPAC Name]
2,3-Butanedithiol, (2S,3S)- [ACD/Index Name]
2,3-Butanedithiol [ACD/Index Name] [ACD/IUPAC Name]
224-870-8 [EINECS]
4532-64-3 [RN]
69307-86-4 [RN]
UNII-69G298U39K

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

Density: 1.0±0.1 g/cm3
Boiling Point: 168.4±13.0 °C at 760 mmHg
Vapour Pressure: 2.1±0.3 mmHg at 25°C
Enthalpy of Vaporization: 38.8±3.0 kJ/mol
Flash Point: 56.8±15.1 °C
Index of Refraction: 1.500
Molar Refractivity: 36.3±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.00
ACD/LogD (pH 5.5): 1.96
ACD/BCF (pH 5.5): 18.17
ACD/KOC (pH 5.5): 277.41
ACD/LogD (pH 7.4): 1.96
ACD/BCF (pH 7.4): 18.12
ACD/KOC (pH 7.4): 276.61
Polar Surface Area: 78 Å2
Polarizability: 14.4±0.5 10-24cm3
Surface Tension: 30.4±3.0 dyne/cm
Molar Volume: 123.4±3.0 cm3

Click to predict properties on the Chemicalize site


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