ChemSpider 2D Image | 4-Hydroxy-5-[(2E,6E)-9-hydroxy-3,7,11-trimethyl-2,6,10-dodecatrien-1-yl]-2,3-dimethoxy-6-methyl-2-cyclohexen-1-one | C24H38O5

4-Hydroxy-5-[(2E,6E)-9-hydroxy-3,7,11-trimethyl-2,6,10-dodecatrien-1-yl]-2,3-dimethoxy-6-methyl-2-cyclohexen-1-one

  • Molecular FormulaC24H38O5
  • Average mass406.556 Da
  • Monoisotopic mass406.271912 Da
  • ChemSpider ID78444741

More details:

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

2-Cyclohexen-1-one, 4-hydroxy-5-[(2E,6E)-9-hydroxy-3,7,11-trimethyl-2,6,10-dodecatrien-1-yl]-2,3-dimethoxy-6-methyl- [ACD/Index Name]
4-Hydroxy-5-[(2E,6E)-9-hydroxy-3,7,11-trimethyl-2,6,10-dodecatrien-1-yl]-2,3-dimethoxy-6-methyl-2-cyclohexen-1-on [German] [ACD/IUPAC Name]
4-Hydroxy-5-[(2E,6E)-9-hydroxy-3,7,11-trimethyl-2,6,10-dodecatrien-1-yl]-2,3-dimethoxy-6-methyl-2-cyclohexen-1-one [ACD/IUPAC Name]
4-Hydroxy-5-[(2E,6E)-9-hydroxy-3,7,11-triméthyl-2,6,10-dodécatrién-1-yl]-2,3-diméthoxy-6-méthyl-2-cyclohexén-1-one [French] [ACD/IUPAC Name]
Antrocamol LT1

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

Density: 1.1±0.1 g/cm3
Boiling Point: 585.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.7 mmHg at 25°C
Enthalpy of Vaporization: 100.4±6.0 kJ/mol
Flash Point: 192.2±23.6 °C
Index of Refraction: 1.520
Molar Refractivity: 116.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 4.94
ACD/LogD (pH 5.5): 4.69
ACD/BCF (pH 5.5): 2161.21
ACD/KOC (pH 5.5): 8483.45
ACD/LogD (pH 7.4): 4.69
ACD/BCF (pH 7.4): 2161.19
ACD/KOC (pH 7.4): 8483.36
Polar Surface Area: 76 Å2
Polarizability: 46.1±0.5 10-24cm3
Surface Tension: 40.7±5.0 dyne/cm
Molar Volume: 382.3±5.0 cm3

Click to predict properties on the Chemicalize site


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