ChemSpider 2D Image | Ethyl 3-carbamothioyl-1-piperidinecarboxylate | C9H16N2O2S

Ethyl 3-carbamothioyl-1-piperidinecarboxylate

  • Molecular FormulaC9H16N2O2S
  • Average mass216.301 Da
  • Monoisotopic mass216.093246 Da
  • ChemSpider ID29273327

More details:

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

1341634-94-3 [RN]
1-Piperidinecarboxylic acid, 3-(aminothioxomethyl)-, ethyl ester [ACD/Index Name]
3-Carbamothioyl-1-pipéridinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 3-carbamothioyl-1-piperidinecarboxylate [ACD/IUPAC Name]
Ethyl 3-carbamothioylpiperidine-1-carboxylate
Ethyl-3-carbamothioyl-1-piperidincarboxylat [German] [ACD/IUPAC Name]
[1341634-94-3] [RN]
860362-70-5 [RN]
Ethyl3-carbamothioylpiperidine-1-carboxylate
ETHYL-3-CARBAMOTHIOYLPIPERIDINE-1-CARBOXYLATE
More...

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

Density: 1.2±0.1 g/cm3
Boiling Point: 342.5±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 58.6±3.0 kJ/mol
Flash Point: 160.9±30.7 °C
Index of Refraction: 1.561
Molar Refractivity: 57.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.42
ACD/LogD (pH 5.5): 0.64
ACD/BCF (pH 5.5): 1.81
ACD/KOC (pH 5.5): 53.14
ACD/LogD (pH 7.4): 0.64
ACD/BCF (pH 7.4): 1.81
ACD/KOC (pH 7.4): 53.14
Polar Surface Area: 88 Å2
Polarizability: 22.8±0.5 10-24cm3
Surface Tension: 56.2±3.0 dyne/cm
Molar Volume: 177.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement