ChemSpider 2D Image | 2-Chloropropanethioamide | C3H6ClNS

2-Chloropropanethioamide

  • Molecular FormulaC3H6ClNS
  • Average mass123.604 Da
  • Monoisotopic mass122.990944 Da
  • ChemSpider ID65667555

More details:

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

2-Chloropropanethioamide [ACD/IUPAC Name]
2-Chloropropanethioamide [French] [ACD/IUPAC Name]
2-Chlorpropanthioamid [German] [ACD/IUPAC Name]
Propanethioamide, 2-chloro- [ACD/Index Name]
2168553-94-2 [RN]
MFCD32754567

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

Density: 1.3±0.1 g/cm3
Boiling Point: 189.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.6±0.4 mmHg at 25°C
Enthalpy of Vaporization: 42.6±3.0 kJ/mol
Flash Point: 68.3±27.9 °C
Index of Refraction: 1.554
Molar Refractivity: 31.6±0.3 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.32
ACD/LogD (pH 5.5): 0.54
ACD/BCF (pH 5.5): 1.52
ACD/KOC (pH 5.5): 46.94
ACD/LogD (pH 7.4): 0.54
ACD/BCF (pH 7.4): 1.52
ACD/KOC (pH 7.4): 46.94
Polar Surface Area: 58 Å2
Polarizability: 12.5±0.5 10-24cm3
Surface Tension: 50.8±3.0 dyne/cm
Molar Volume: 98.5±3.0 cm3

Click to predict properties on the Chemicalize site


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