ChemSpider 2D Image | 1,1-Dihydroxy-1-octadecen-7-yl 9-anthracenecarboxylate | C33H44O4

1,1-Dihydroxy-1-octadecen-7-yl 9-anthracenecarboxylate

  • Molecular FormulaC33H44O4
  • Average mass504.700 Da
  • Monoisotopic mass504.323975 Da
  • ChemSpider ID95681020

More details:

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

1,1-Dihydroxy-1-octadecen-7-yl 9-anthracenecarboxylate [ACD/IUPAC Name]
1,1-Dihydroxy-1-octadecen-7-yl-9-anthracencarboxylat [German] [ACD/IUPAC Name]
9-Anthracènecarboxylate de 1,1-dihydroxy-1-octadécén-7-yle [French] [ACD/IUPAC Name]
9-Anthracenecarboxylic acid, 1-(6,6-dihydroxy-5-hexen-1-yl)dodecyl ester [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 686.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 105.7±3.0 kJ/mol
Flash Point: 215.8±25.0 °C
Index of Refraction: 1.583
Molar Refractivity: 155.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 2
ACD/LogP: 11.67
ACD/LogD (pH 5.5): 10.93
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 10.93
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 67 Å2
Polarizability: 61.6±0.5 10-24cm3
Surface Tension: 45.9±3.0 dyne/cm
Molar Volume: 465.0±3.0 cm3

Click to predict properties on the Chemicalize site


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