ChemSpider 2D Image | 2-Amino-2-ethyl-1,3-propanedithiol | C5H13NS2

2-Amino-2-ethyl-1,3-propanedithiol

  • Molecular FormulaC5H13NS2
  • Average mass151.293 Da
  • Monoisotopic mass151.048935 Da
  • ChemSpider ID60758026

More details:

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

1,3-Propanedithiol, 2-amino-2-ethyl- [ACD/Index Name]
2-Amino-2-ethyl-1,3-propandithiol [German] [ACD/IUPAC Name]
2-Amino-2-ethyl-1,3-propanedithiol [ACD/IUPAC Name]
2-Amino-2-éthyl-1,3-propanedithiol [French] [ACD/IUPAC Name]
749784-85-8 [RN]
MFCD18806011

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

Density: 1.1±0.1 g/cm3
Boiling Point: 238.7±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.6±3.0 kJ/mol
Flash Point: 98.2±24.6 °C
Index of Refraction: 1.535
Molar Refractivity: 44.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.91
ACD/LogD (pH 5.5): -0.32
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.33
ACD/LogD (pH 7.4): 1.21
ACD/BCF (pH 7.4): 4.19
ACD/KOC (pH 7.4): 80.18
Polar Surface Area: 104 Å2
Polarizability: 17.6±0.5 10-24cm3
Surface Tension: 39.8±3.0 dyne/cm
Molar Volume: 142.9±3.0 cm3

Click to predict properties on the Chemicalize site


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