ChemSpider 2D Image | (9cis,13cis)-4-Hydroxy(20,20,20-~2~H_3_)retinoic acid | C20H25D3O3

(9cis,13cis)-4-Hydroxy(20,20,20-2H3)retinoic acid

  • Molecular FormulaC20H25D3O3
  • Average mass319.453 Da
  • Monoisotopic mass319.222687 Da
  • ChemSpider ID48061366
  • Double-bond stereo - Double-bond stereo

    Non-standard isotope - Non-standard isotope


More details:






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

(9cis,13cis)-4-Hydroxy(20,20,20-2H3)retinoic acid [ACD/IUPAC Name]
(9cis,13cis)-4-Hydroxy(20,20,20-2H3)rétinoïque acide [French] [ACD/IUPAC Name]
Retinoic acid-20,20,20-d3, 4-hydroxy-, (9cis,13cis)- [ACD/Index Name]
1346606-21-0 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 506.5±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 89.4±6.0 kJ/mol
Flash Point: 274.2±21.9 °C
Index of Refraction: 1.574
Molar Refractivity: 97.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.93
ACD/LogD (pH 5.5): 3.95
ACD/BCF (pH 5.5): 377.39
ACD/KOC (pH 5.5): 1433.06
ACD/LogD (pH 7.4): 2.15
ACD/BCF (pH 7.4): 6.04
ACD/KOC (pH 7.4): 22.92
Polar Surface Area: 58 Å2
Polarizability: 38.5±0.5 10-24cm3
Surface Tension: 44.2±3.0 dyne/cm
Molar Volume: 294.1±3.0 cm3

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