ChemSpider 2D Image | 2-Cyano-2-(hydroxyimino)ethanethioamide | C3H3N3OS

2-Cyano-2-(hydroxyimino)ethanethioamide

  • Molecular FormulaC3H3N3OS
  • Average mass129.140 Da
  • Monoisotopic mass128.999680 Da
  • ChemSpider ID26465823

More details:

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

2-Cyan-2-(hydroxyimino)ethanthioamid [German] [ACD/IUPAC Name]
2-Cyano-2-(hydroxyimino)ethanethioamide [ACD/IUPAC Name]
2-Cyano-2-(hydroxyimino)éthanethioamide [French] [ACD/IUPAC Name]
Ethanethioamide, 2-cyano-2-(hydroxyimino)- [ACD/Index Name]
50834-04-3 [RN]
carbamothioylmethanecarbonimidoyl cyanide
MFCD06245209
MFCD19216301

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

Density: 1.5±0.1 g/cm3
Boiling Point: 312.7±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 64.2±6.0 kJ/mol
Flash Point: 142.9±23.2 °C
Index of Refraction: 1.664
Molar Refractivity: 31.4±0.5 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.55
ACD/LogD (pH 5.5): -0.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.66
ACD/LogD (pH 7.4): -1.69
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 114 Å2
Polarizability: 12.5±0.5 10-24cm3
Surface Tension: 63.0±7.0 dyne/cm
Molar Volume: 84.7±7.0 cm3

Click to predict properties on the Chemicalize site


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