ChemSpider 2D Image | N-Cyanoethanethioamide | C3H4N2S

N-Cyanoethanethioamide

  • Molecular FormulaC3H4N2S
  • Average mass100.142 Da
  • Monoisotopic mass100.009521 Da
  • ChemSpider ID24541182

More details:

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

Ethanethioamide, N-cyano- [ACD/Index Name]
N-Cyanethanthioamid [German] [ACD/IUPAC Name]
N-Cyanoethanethioamide [ACD/IUPAC Name]
N-Cyanoéthanethioamide [French] [ACD/IUPAC Name]
503621-72-5 [RN]
7357-70-2 [RN]
amino(thioxoethyl)carbonitrile
Cyanothioacetamide
MFCD18083649

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

Density: 1.2±0.1 g/cm3
Boiling Point: 131.4±23.0 °C at 760 mmHg
Vapour Pressure: 9.3±0.2 mmHg at 25°C
Enthalpy of Vaporization: 36.9±3.0 kJ/mol
Flash Point: 33.3±22.6 °C
Index of Refraction: 1.540
Molar Refractivity: 26.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.29
ACD/LogD (pH 5.5): -0.85
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.53
ACD/LogD (pH 7.4): -1.96
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 68 Å2
Polarizability: 10.6±0.5 10-24cm3
Surface Tension: 57.1±3.0 dyne/cm
Molar Volume: 85.2±3.0 cm3

Click to predict properties on the Chemicalize site


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