ChemSpider 2D Image | 2-(Adamantan-1-yl)-N-isopropylethanethioamide | C15H25NS

2-(Adamantan-1-yl)-N-isopropylethanethioamide

  • Molecular FormulaC15H25NS
  • Average mass251.431 Da
  • Monoisotopic mass251.170776 Da
  • ChemSpider ID26405222

More details:

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

2-(Adamantan-1-yl)-N-isopropylethanethioamide [ACD/IUPAC Name]
2-(Adamantan-1-yl)-N-isopropyléthanethioamide [French] [ACD/IUPAC Name]
2-(Adamantan-1-yl)-N-isopropylethanthioamid [German] [ACD/IUPAC Name]
Tricyclo[3.3.1.13,7]decane-1-ethanethioamide, N-(1-methylethyl)- [ACD/Index Name]
2-Adamantan-1-yl-N-isopropyl-thioacetamide

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

Density: 1.1±0.1 g/cm3
Boiling Point: 338.5±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.2±3.0 kJ/mol
Flash Point: 158.5±23.2 °C
Index of Refraction: 1.560
Molar Refractivity: 76.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.81
ACD/LogD (pH 5.5): 4.56
ACD/BCF (pH 5.5): 1725.91
ACD/KOC (pH 5.5): 7221.63
ACD/LogD (pH 7.4): 4.56
ACD/BCF (pH 7.4): 1726.16
ACD/KOC (pH 7.4): 7222.69
Polar Surface Area: 44 Å2
Polarizability: 30.2±0.5 10-24cm3
Surface Tension: 46.9±3.0 dyne/cm
Molar Volume: 235.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement