ChemSpider 2D Image | metachromin W | C22H26O3

metachromin W

  • Molecular FormulaC22H26O3
  • Average mass338.440 Da
  • Monoisotopic mass338.188202 Da
  • ChemSpider ID26341551

More details:

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

1,4-Naphthalenedione, 6-[2-(2,2-dimethyl-6-methylenecyclohexyl)ethyl]-2-methoxy- [ACD/Index Name]
6-[2-(2,2-Dimethyl-6-methylencyclohexyl)ethyl]-2-methoxy-1,4-naphthochinon [German] [ACD/IUPAC Name]
6-[2-(2,2-Dimethyl-6-methylenecyclohexyl)ethyl]-2-methoxy-1,4-naphthoquinone [ACD/IUPAC Name]
6-[2-(2,2-Diméthyl-6-méthylènecyclohexyl)éthyl]-2-méthoxy-1,4-naphtoquinone [French] [ACD/IUPAC Name]
metachromin W

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

Density: 1.1±0.1 g/cm3
Boiling Point: 486.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.2±3.0 kJ/mol
Flash Point: 211.9±28.8 °C
Index of Refraction: 1.561
Molar Refractivity: 97.9±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 6.53
ACD/LogD (pH 5.5): 5.39
ACD/BCF (pH 5.5): 7338.51
ACD/KOC (pH 5.5): 20351.33
ACD/LogD (pH 7.4): 5.39
ACD/BCF (pH 7.4): 7338.51
ACD/KOC (pH 7.4): 20351.33
Polar Surface Area: 43 Å2
Polarizability: 38.8±0.5 10-24cm3
Surface Tension: 43.3±5.0 dyne/cm
Molar Volume: 302.6±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement