ChemSpider 2D Image | 3-(1-Formylcyclohexyl)propanethioamide | C10H17NOS

3-(1-Formylcyclohexyl)propanethioamide

  • Molecular FormulaC10H17NOS
  • Average mass199.313 Da
  • Monoisotopic mass199.103088 Da
  • ChemSpider ID28545139

More details:

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

3-(1-Formylcyclohexyl)propanethioamide [ACD/IUPAC Name]
3-(1-Formylcyclohexyl)propanethioamide [French] [ACD/IUPAC Name]
3-(1-Formylcyclohexyl)propanthioamid [German] [ACD/IUPAC Name]
Cyclohexanepropanethioamide, 1-formyl- [ACD/Index Name]
1354950-85-8 [RN]
MFCD20233519

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

Density: 1.1±0.1 g/cm3
Boiling Point: 323.0±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.5±3.0 kJ/mol
Flash Point: 149.2±25.7 °C
Index of Refraction: 1.592
Molar Refractivity: 59.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.73
ACD/LogD (pH 5.5): 1.74
ACD/BCF (pH 5.5): 12.37
ACD/KOC (pH 5.5): 210.62
ACD/LogD (pH 7.4): 1.74
ACD/BCF (pH 7.4): 12.37
ACD/KOC (pH 7.4): 210.65
Polar Surface Area: 75 Å2
Polarizability: 23.4±0.5 10-24cm3
Surface Tension: 57.1±3.0 dyne/cm
Molar Volume: 174.2±3.0 cm3

Click to predict properties on the Chemicalize site


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