ChemSpider 2D Image | 9-{3-Ethoxy-4-[(2-methyl-1-naphthyl)methoxy]phenyl}-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione | C33H32O5

9-{3-Ethoxy-4-[(2-methyl-1-naphthyl)methoxy]phenyl}-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione

  • Molecular FormulaC33H32O5
  • Average mass508.604 Da
  • Monoisotopic mass508.224976 Da
  • ChemSpider ID81289798

More details:

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

1H-Xanthene-1,8(2H)-dione, 9-[3-ethoxy-4-[(2-methyl-1-naphthalenyl)methoxy]phenyl]-3,4,5,6,7,9-hexahydro- [ACD/Index Name]
9-{3-Ethoxy-4-[(2-methyl-1-naphthyl)methoxy]phenyl}-3,4,5,6,7,9-hexahydro-1H-xanthen-1,8(2H)-dion [German] [ACD/IUPAC Name]
9-{3-Ethoxy-4-[(2-methyl-1-naphthyl)methoxy]phenyl}-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione [ACD/IUPAC Name]
9-{3-Éthoxy-4-[(2-méthyl-1-naphtyl)méthoxy]phényl}-3,4,5,6,7,9-hexahydro-1H-xanthène-1,8(2H)-dione [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 711.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.1±3.0 kJ/mol
Flash Point: 299.6±32.9 °C
Index of Refraction: 1.650
Molar Refractivity: 145.9±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 5.70
ACD/LogD (pH 5.5): 5.92
ACD/BCF (pH 5.5): 18464.11
ACD/KOC (pH 5.5): 39393.51
ACD/LogD (pH 7.4): 5.92
ACD/BCF (pH 7.4): 18464.11
ACD/KOC (pH 7.4): 39393.51
Polar Surface Area: 62 Å2
Polarizability: 57.9±0.5 10-24cm3
Surface Tension: 57.0±5.0 dyne/cm
Molar Volume: 400.1±5.0 cm3

Click to predict properties on the Chemicalize site


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