ChemSpider 2D Image | capillobenzopyranol | C22H26O3

capillobenzopyranol

  • Molecular FormulaC22H26O3
  • Average mass338.440 Da
  • Monoisotopic mass338.188202 Da
  • ChemSpider ID24671865

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-2,7-Dimethyl-2-[(3E)-4-methyl-5-(4-methyl-2-furyl)-3-penten-1-yl]-2H-chromen-6-ol [German] [ACD/IUPAC Name]
(2R)-2,7-Dimethyl-2-[(3E)-4-methyl-5-(4-methyl-2-furyl)-3-penten-1-yl]-2H-chromen-6-ol [ACD/IUPAC Name]
(2R)-2,7-Diméthyl-2-[(3E)-4-méthyl-5-(4-méthyl-2-furyl)-3-pentén-1-yl]-2H-chromén-6-ol [French] [ACD/IUPAC Name]
2H-1-Benzopyran-6-ol, 2,7-dimethyl-2-[(3E)-4-methyl-5-(4-methyl-2-furanyl)-3-penten-1-yl]-, (2R)- [ACD/Index Name]
capillobenzopyranol

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

Density: 1.1±0.1 g/cm3
Boiling Point: 481.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.4±3.0 kJ/mol
Flash Point: 244.9±28.7 °C
Index of Refraction: 1.559
Molar Refractivity: 100.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 6.90
ACD/LogD (pH 5.5): 6.32
ACD/BCF (pH 5.5): 37304.21
ACD/KOC (pH 5.5): 65169.87
ACD/LogD (pH 7.4): 6.32
ACD/BCF (pH 7.4): 37280.50
ACD/KOC (pH 7.4): 65128.45
Polar Surface Area: 43 Å2
Polarizability: 39.8±0.5 10-24cm3
Surface Tension: 43.2±3.0 dyne/cm
Molar Volume: 310.5±3.0 cm3

Click to predict properties on the Chemicalize site


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