ChemSpider 2D Image | 2-{[2-(Adamantan-1-yl)ethyl]sulfanyl}-N-(2,4-dimethoxyphenyl)acetamide | C22H31NO3S

2-{[2-(Adamantan-1-yl)ethyl]sulfanyl}-N-(2,4-dimethoxyphenyl)acetamide

  • Molecular FormulaC22H31NO3S
  • Average mass389.551 Da
  • Monoisotopic mass389.202454 Da
  • ChemSpider ID22766851

More details:

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

2-{[2-(Adamantan-1-yl)ethyl]sulfanyl}-N-(2,4-dimethoxyphenyl)acetamid [German] [ACD/IUPAC Name]
2-{[2-(Adamantan-1-yl)ethyl]sulfanyl}-N-(2,4-dimethoxyphenyl)acetamide [ACD/IUPAC Name]
2-{[2-(Adamantan-1-yl)éthyl]sulfanyl}-N-(2,4-diméthoxyphényl)acétamide [French] [ACD/IUPAC Name]
Acetamide, N-(2,4-dimethoxyphenyl)-2-[(2-tricyclo[3.3.1.13,7]dec-1-ylethyl)thio]- [ACD/Index 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: 545.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.5±3.0 kJ/mol
Flash Point: 284.0±28.7 °C
Index of Refraction: 1.594
Molar Refractivity: 111.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.46
ACD/LogD (pH 5.5): 5.23
ACD/BCF (pH 5.5): 5583.75
ACD/KOC (pH 5.5): 16732.43
ACD/LogD (pH 7.4): 5.23
ACD/BCF (pH 7.4): 5587.43
ACD/KOC (pH 7.4): 16743.43
Polar Surface Area: 73 Å2
Polarizability: 44.1±0.5 10-24cm3
Surface Tension: 49.2±3.0 dyne/cm
Molar Volume: 327.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement