ChemSpider 2D Image | 13-[(2Z)-3,7-Dimethyl-2,6-octadien-1-yl]-1,3,8-trihydroxy-5,5,11,11-tetramethyl-5a,6-dihydro-5H,7H,11H-[1]benzofuro[3,4-bc]pyrano[2,3-i]xanthen-7-one | C35H38O7

13-[(2Z)-3,7-Dimethyl-2,6-octadien-1-yl]-1,3,8-trihydroxy-5,5,11,11-tetramethyl-5a,6-dihydro-5H,7H,11H-[1]benzofuro[3,4-bc]pyrano[2,3-i]xanthen-7-one

  • Molecular FormulaC35H38O7
  • Average mass570.672 Da
  • Monoisotopic mass570.261780 Da
  • ChemSpider ID8275074
  • Double-bond stereo - Double-bond stereo


More details:






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

13-[(2Z)-3,7-Dimethyl-2,6-octadien-1-yl]-1,3,8-trihydroxy-5,5,11,11-tetramethyl-5a,6-dihydro-5H,7H,11H-[1]benzofuro[3,4-bc]pyrano[2,3-i]xanthen-7-on [German] [ACD/IUPAC Name]
13-[(2Z)-3,7-Dimethyl-2,6-octadien-1-yl]-1,3,8-trihydroxy-5,5,11,11-tetramethyl-5a,6-dihydro-5H,7H,11H-[1]benzofuro[3,4-bc]pyrano[2,3-i]xanthen-7-one [ACD/IUPAC Name]
13-[(2Z)-3,7-Diméthyl-2,6-octadién-1-yl]-1,3,8-trihydroxy-5,5,11,11-tétraméthyl-5a,6-dihydro-5H,7H,11H-[1]benzofuro[3,4-bc]pyrano[2,3-i]xanthén-7-one [French] [ACD/IUPAC Name]
5H,7H,11H-Benzofuro[3,4-bc]pyrano[2,3-i]xanthen-7-one, 13-[(2Z)-3,7-dimethyl-2,6-octadien-1-yl]-5a,6-dihydro-1,3,8-trihydroxy-5,5,11,11-tetramethyl- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 787.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 118.6±3.0 kJ/mol
Flash Point: 252.1±26.4 °C
Index of Refraction: 1.669
Molar Refractivity: 158.4±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 9.42
ACD/LogD (pH 5.5): 8.81
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1450869.13
ACD/LogD (pH 7.4): 8.14
ACD/BCF (pH 7.4): 613602.44
ACD/KOC (pH 7.4): 306764.75
Polar Surface Area: 105 Å2
Polarizability: 62.8±0.5 10-24cm3
Surface Tension: 65.5±5.0 dyne/cm
Molar Volume: 424.7±5.0 cm3

Click to predict properties on the Chemicalize site






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