ChemSpider 2D Image | N-Carbamothioylethanethioamide | C3H6N2S2

N-Carbamothioylethanethioamide

  • Molecular FormulaC3H6N2S2
  • Average mass134.223 Da
  • Monoisotopic mass133.997238 Da
  • ChemSpider ID28709018

More details:

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

Ethanethioamide, N-(aminothioxomethyl)- [ACD/Index Name]
N-Carbamothioylethanethioamide [ACD/IUPAC Name]
N-Carbamothioyléthanethioamide [French] [ACD/IUPAC Name]
N-Carbamothioylethanthioamid [German] [ACD/IUPAC Name]
91936-07-1 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 215.8±23.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 45.2±3.0 kJ/mol
Flash Point: 84.3±22.6 °C
Index of Refraction: 1.672
Molar Refractivity: 37.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.42
ACD/LogD (pH 5.5): -0.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 16.19
ACD/LogD (pH 7.4): -0.37
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 14.03
Polar Surface Area: 102 Å2
Polarizability: 14.9±0.5 10-24cm3
Surface Tension: 81.0±3.0 dyne/cm
Molar Volume: 100.5±3.0 cm3

Click to predict properties on the Chemicalize site


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