ChemSpider 2D Image | Epi-guaiacin | C20H24O4

Epi-guaiacin

  • Molecular FormulaC20H24O4
  • Average mass328.402 Da
  • Monoisotopic mass328.167450 Da
  • ChemSpider ID28944958

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(6R,7R,8S)-8-(4-Hydroxy-3-méthoxyphényl)-3-méthoxy-6,7-diméthyl-5,6,7,8-tétrahydro-2-naphtalénol [French] [ACD/IUPAC Name]
(6R,7R,8S)-8-(4-Hydroxy-3-methoxyphenyl)-3-methoxy-6,7-dimethyl-5,6,7,8-tetrahydro-2-naphthalenol [ACD/IUPAC Name]
(6R,7R,8S)-8-(4-Hydroxy-3-methoxyphenyl)-3-methoxy-6,7-dimethyl-5,6,7,8-tetrahydro-2-naphthalinol [German] [ACD/IUPAC Name]
2-Naphthalenol, 5,6,7,8-tetrahydro-8-(4-hydroxy-3-methoxyphenyl)-3-methoxy-6,7-dimethyl-, (6R,7R,8S)- [ACD/Index Name]
Epi-guaiacin

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

Density: 1.2±0.1 g/cm3
Boiling Point: 484.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.8±3.0 kJ/mol
Flash Point: 246.8±28.7 °C
Index of Refraction: 1.573
Molar Refractivity: 94.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.06
ACD/LogD (pH 5.5): 3.94
ACD/BCF (pH 5.5): 583.27
ACD/KOC (pH 5.5): 3322.08
ACD/LogD (pH 7.4): 3.94
ACD/BCF (pH 7.4): 581.45
ACD/KOC (pH 7.4): 3311.67
Polar Surface Area: 59 Å2
Polarizability: 37.3±0.5 10-24cm3
Surface Tension: 42.6±3.0 dyne/cm
Molar Volume: 285.3±3.0 cm3

Click to predict properties on the Chemicalize site


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