ChemSpider 2D Image | 2-[(3E)-4,8-Dimethyl-3,7-nonadien-1-yl]-6-methyl-2H-chromen-8-ol | C21H28O2

2-[(3E)-4,8-Dimethyl-3,7-nonadien-1-yl]-6-methyl-2H-chromen-8-ol

  • Molecular FormulaC21H28O2
  • Average mass312.446 Da
  • Monoisotopic mass312.208923 Da
  • ChemSpider ID35516803

  • Double-bond stereo - Double-bond stereo

More details:

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

2-[(3E)-4,8-Dimethyl-3,7-nonadien-1-yl]-6-methyl-2H-chromen-8-ol [German] [ACD/IUPAC Name]
2-[(3E)-4,8-Dimethyl-3,7-nonadien-1-yl]-6-methyl-2H-chromen-8-ol [ACD/IUPAC Name]
2-[(3E)-4,8-Diméthyl-3,7-nonadién-1-yl]-6-méthyl-2H-chromén-8-ol [French] [ACD/IUPAC Name]
2H-1-Benzopyran-8-ol, 2-[(3E)-4,8-dimethyl-3,7-nonadien-1-yl]-6-methyl- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 440.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.5±3.0 kJ/mol
Flash Point: 184.1±23.0 °C
Index of Refraction: 1.543
Molar Refractivity: 97.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 7.25
ACD/LogD (pH 5.5): 6.44
ACD/BCF (pH 5.5): 46324.64
ACD/KOC (pH 5.5): 76095.27
ACD/LogD (pH 7.4): 6.44
ACD/BCF (pH 7.4): 45944.53
ACD/KOC (pH 7.4): 75470.89
Polar Surface Area: 29 Å2
Polarizability: 38.5±0.5 10-24cm3
Surface Tension: 39.2±3.0 dyne/cm
Molar Volume: 308.3±3.0 cm3

Click to predict properties on the Chemicalize site


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