ChemSpider 2D Image | (11cis)-15-Oxidoretinal | C20H27O2

(11cis)-15-Oxidoretinal

  • Molecular FormulaC20H27O2
  • Average mass299.428 Da
  • Monoisotopic mass299.201660 Da
  • ChemSpider ID58163884

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

More details:

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

(11cis)-15-Oxidoretinal [German] [ACD/IUPAC Name]
(11cis)-15-Oxidoretinal [ACD/IUPAC Name]
(11cis)-15-Oxydorétinal [French] [ACD/IUPAC Name]
Retinoic acid, ion(1-), (11cis)- [ACD/Index Name]
(2E,4Z,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoate
11-cis-retinoate
  • Miscellaneous

    • Chemical Class:

      A retinoate that is the conjugate base of 11-cis-retinoic acid, obtaained by deprotonation of the carboxy group; major species at pH 7.3. ChEBI CHEBI:87435

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

Density:
Boiling Point: 462.8±14.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 79.3±6.0 kJ/mol
Flash Point: 350.6±11.0 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 6.83
ACD/LogD (pH 5.5): 5.06
ACD/BCF (pH 5.5): 2580.25
ACD/KOC (pH 5.5): 5560.61
ACD/LogD (pH 7.4): 3.26
ACD/BCF (pH 7.4): 41.02
ACD/KOC (pH 7.4): 88.40
Polar Surface Area: 40 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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