ChemSpider 2D Image | 2-Chloro-N-methylethanethioamide | C3H6ClNS

2-Chloro-N-methylethanethioamide

  • Molecular FormulaC3H6ClNS
  • Average mass123.604 Da
  • Monoisotopic mass122.990944 Da
  • ChemSpider ID32990369

More details:

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

2-Chlor-N-methylethanthioamid [German] [ACD/IUPAC Name]
2-Chloro-N-methylethanethioamide [ACD/IUPAC Name]
2-Chloro-N-méthyléthanethioamide [French] [ACD/IUPAC Name]
Ethanethioamide, 2-chloro-N-methyl- [ACD/Index Name]
113847-67-9 [RN]
MFCD19224275

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

Density: 1.2±0.1 g/cm3
Boiling Point: 156.2±42.0 °C at 760 mmHg
Vapour Pressure: 2.9±0.3 mmHg at 25°C
Enthalpy of Vaporization: 39.3±3.0 kJ/mol
Flash Point: 48.3±27.9 °C
Index of Refraction: 1.526
Molar Refractivity: 31.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.75
ACD/LogD (pH 5.5): 0.83
ACD/BCF (pH 5.5): 2.50
ACD/KOC (pH 5.5): 67.04
ACD/LogD (pH 7.4): 0.83
ACD/BCF (pH 7.4): 2.50
ACD/KOC (pH 7.4): 67.04
Polar Surface Area: 44 Å2
Polarizability: 12.6±0.5 10-24cm3
Surface Tension: 43.0±3.0 dyne/cm
Molar Volume: 103.2±3.0 cm3

Click to predict properties on the Chemicalize site


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