ChemSpider 2D Image | cd3254 | C24H28O3


  • Molecular FormulaC24H28O3
  • Average mass364.477 Da
  • Monoisotopic mass364.203857 Da
  • ChemSpider ID23338685
  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-[4-Hydroxy-3-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydro-2-naphthalenyl)phenyl]acrylic acid [ACD/IUPAC Name]
(2E)-3-[4-Hydroxy-3-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydro-2-naphthalinyl)phenyl]acrylsäure [German] [ACD/IUPAC Name]
(2E)-3-[4-Hydroxy-3-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]acrylic acid
196961-43-0 [RN]
2-Propenoic acid, 3-[4-hydroxy-3-(5,6,7,8-tetrahydro-3,5,5,8,8-pentamethyl-2-naphthalenyl)phenyl]-, (2E)- [ACD/Index Name]
Acide (2E)-3-[4-hydroxy-3-(3,5,5,8,8-pentaméthyl-5,6,7,8-tétrahydro-2-naphtalényl)phényl]acrylique [French] [ACD/IUPAC Name]
CD 3254
(2E)-3-[4-hydroxy-3-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]prop-2-enoic acid
(E)-3-(4-hydroxy-3-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)phenyl)acrylic acid
  • Experimental Physico-chemical Properties
  • Miscellaneous
    • Bio Activity:

      Nuclear Receptors Tocris Bioscience 3302
      Potent and selective RXR? agonist. Tocris Bioscience 3302
      Potent and selective RXRalpha agonist. Tocris Bioscience 3302
      Retinoid X Receptor Tocris Bioscience 3302
      Selective RXR? agonist; exhibits no activity at RAR?, RAR? or RAR? receptors. Tocris Bioscience 3302
      Selective RXRalpha agonist; exhibits no activity at RARalpha, RARbeta or RARgamma receptors. Tocris Bioscience 3302

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 508.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.9±3.0 kJ/mol
Flash Point: 275.1±26.6 °C
Index of Refraction: 1.587
Molar Refractivity: 110.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 7.55
ACD/LogD (pH 5.5): 5.01
ACD/BCF (pH 5.5): 1887.96
ACD/KOC (pH 5.5): 3388.52
ACD/LogD (pH 7.4): 3.22
ACD/BCF (pH 7.4): 30.95
ACD/KOC (pH 7.4): 55.55
Polar Surface Area: 58 Å2
Polarizability: 43.8±0.5 10-24cm3
Surface Tension: 44.8±3.0 dyne/cm
Molar Volume: 328.7±3.0 cm3

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