ChemSpider 2D Image | N-[(3s,5s,7s)-Adamantan-1-yl]-2-[(4-methylphenyl)sulfanyl]acetamide | C19H25NOS

N-[(3s,5s,7s)-Adamantan-1-yl]-2-[(4-methylphenyl)sulfanyl]acetamide

  • Molecular FormulaC19H25NOS
  • Average mass315.473 Da
  • Monoisotopic mass315.165680 Da
  • ChemSpider ID62680907

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

Acetamide, 2-[(4-methylphenyl)thio]-N-tricyclo[3.3.1.13,7]dec-1-yl- [ACD/Index Name]
N-[(3s,5s,7s)-Adamantan-1-yl]-2-[(4-methylphenyl)sulfanyl]acetamid [German] [ACD/IUPAC Name]
N-[(3s,5s,7s)-Adamantan-1-yl]-2-[(4-methylphenyl)sulfanyl]acetamide [ACD/IUPAC Name]
N-[(3s,5s,7s)-Adamantan-1-yl]-2-[(4-méthylphényl)sulfanyl]acétamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 495.2±24.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.3±3.0 kJ/mol
Flash Point: 253.3±22.9 °C
Index of Refraction: 1.610
Molar Refractivity: 92.5±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.48
ACD/LogD (pH 5.5): 4.55
ACD/BCF (pH 5.5): 1689.12
ACD/KOC (pH 5.5): 7111.42
ACD/LogD (pH 7.4): 4.55
ACD/BCF (pH 7.4): 1689.12
ACD/KOC (pH 7.4): 7111.43
Polar Surface Area: 54 Å2
Polarizability: 36.7±0.5 10-24cm3
Surface Tension: 50.1±5.0 dyne/cm
Molar Volume: 267.0±5.0 cm3

Click to predict properties on the Chemicalize site


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