ChemSpider 2D Image | 2-(9-Anthroyloxy)stearic acid | C33H44O4

2-(9-Anthroyloxy)stearic acid

  • Molecular FormulaC33H44O4
  • Average mass504.700 Da
  • Monoisotopic mass504.323975 Da
  • ChemSpider ID117258

More details:

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

2-(9-anthroyloxy)-stearic acid
2-(9-Anthroyloxy)stearic acid
2-[(9-Anthrylcarbonyl)oxy]octadecanoic acid [ACD/IUPAC Name]
2-[(9-Anthrylcarbonyl)oxy]octadecansäure [German] [ACD/IUPAC Name]
78447-89-9 [RN]
9-Anthracenecarboxylic acid, 1-carboxyheptadecyl ester [ACD/Index Name]
Acide 2-[(9-anthrylcarbonyl)oxy]octadécanoïque [French] [ACD/IUPAC Name]
(±)-2-(9-anthroyloxy)-stearic acid
2-(anthracene-9-carbonyloxy)octadecanoic acid
82911-13-5 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 670.3±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.5±3.0 kJ/mol
Flash Point: 209.9±20.3 °C
Index of Refraction: 1.567
Molar Refractivity: 154.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 2
ACD/LogP: 12.61
ACD/LogD (pH 5.5): 9.10
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 133630.63
ACD/LogD (pH 7.4): 8.04
ACD/BCF (pH 7.4): 98264.33
ACD/KOC (pH 7.4): 11669.17
Polar Surface Area: 64 Å2
Polarizability: 61.0±0.5 10-24cm3
Surface Tension: 44.3±3.0 dyne/cm
Molar Volume: 471.2±3.0 cm3

Click to predict properties on the Chemicalize site


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