ChemSpider 2D Image | 16-Hydroxyretinoic acid | C20H28O3

16-Hydroxyretinoic acid

  • Molecular FormulaC20H28O3
  • Average mass316.435 Da
  • Monoisotopic mass316.203857 Da
  • ChemSpider ID58190935

  • Double-bond stereo - Double-bond stereo

More details:

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

16-Hydroxyretinoic acid [ACD/IUPAC Name]
16-Hydroxyrétinoïque acide [French] [ACD/IUPAC Name]
Retinoic acid, 16-hydroxy- [ACD/Index Name]
(2E,4E,6E,8E)-9-[6-(hydroxymethyl)-2,6-dimethylcyclohex-1-en-1-yl]-3,7-dimethylnona-2,4,6,8-tetraenoic acid
126532-33-0 [RN]
16-hydroxy-all-trans-retinoic acid
16-Hydroxyisotretinoin
all-trans-16-hydroxyretinoic acid
Retinoic acid,16-hydroxy-, 13-cis-(????)- (9CI)

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

Density: 1.1±0.1 g/cm3
Boiling Point: 512.2±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 90.2±6.0 kJ/mol
Flash Point: 277.7±19.1 °C
Index of Refraction: 1.570
Molar Refractivity: 97.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.96
ACD/LogD (pH 5.5): 3.95
ACD/BCF (pH 5.5): 370.63
ACD/KOC (pH 5.5): 1386.48
ACD/LogD (pH 7.4): 2.15
ACD/BCF (pH 7.4): 5.89
ACD/KOC (pH 7.4): 22.04
Polar Surface Area: 58 Å2
Polarizability: 38.5±0.5 10-24cm3
Surface Tension: 43.7±3.0 dyne/cm
Molar Volume: 295.7±3.0 cm3

Click to predict properties on the Chemicalize site


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