ChemSpider 2D Image | (9cis,13cis)-11,12-Didehydroretinol | C20H28O

(9cis,13cis)-11,12-Didehydroretinol

  • Molecular FormulaC20H28O
  • Average mass284.436 Da
  • Monoisotopic mass284.214020 Da
  • ChemSpider ID57509603

  • Double-bond stereo - Double-bond stereo

More details:

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

(9cis,13cis)-11,12-Didehydroretinol [German] [ACD/IUPAC Name]
(9cis,13cis)-11,12-Didehydroretinol [ACD/IUPAC Name]
(9cis,13cis)-11,12-Didéhydrorétinol [French] [ACD/IUPAC Name]
Retinol, 11,12-didehydro-, (9cis,13cis)- [ACD/Index Name]
3,7-DIMETHYL-9-(2,6,6-TRIMETHYLCYCLOHEX-1-EN-1-YL)NONA-2,6,8-TRIEN-4-YN-1-OL

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

Density: 1.0±0.1 g/cm3
Boiling Point: 424.4±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 78.4±6.0 kJ/mol
Flash Point: 186.6±17.0 °C
Index of Refraction: 1.558
Molar Refractivity: 93.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 7.16
ACD/LogD (pH 5.5): 6.11
ACD/BCF (pH 5.5): 25771.29
ACD/KOC (pH 5.5): 50012.28
ACD/LogD (pH 7.4): 6.11
ACD/BCF (pH 7.4): 25771.29
ACD/KOC (pH 7.4): 50012.28
Polar Surface Area: 20 Å2
Polarizability: 37.0±0.5 10-24cm3
Surface Tension: 39.8±3.0 dyne/cm
Molar Volume: 289.7±3.0 cm3

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