ChemSpider 2D Image | 6-Oxo-6-(9-phenanthryl)hexanoic acid | C20H18O3

6-Oxo-6-(9-phenanthryl)hexanoic acid

  • Molecular FormulaC20H18O3
  • Average mass306.355 Da
  • Monoisotopic mass306.125580 Da
  • ChemSpider ID21401683

More details:






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

6-Oxo-6-(9-phenanthryl)hexanoic acid [ACD/IUPAC Name]
6-Oxo-6-(9-phenanthryl)hexansäure [German] [ACD/IUPAC Name]
898766-05-7 [RN]
9-Phenanthrenehexanoic acid, ε-oxo- [ACD/Index Name]
Acide 6-oxo-6-(9-phénanthryl)hexanoïque [French] [ACD/IUPAC Name]
[898766-05-7] [RN]
6-Oxo-6-(9-Phenanthryl)hexanoicacid
6-OXO-6-(PHENANTHREN-9-YL)HEXANOIC ACID
6-oxo-6-phenanthren-9-ylhexanoic acid
MFCD01320095 [MDL number]
  • Miscellaneous

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

Density: 1.2±0.1 g/cm3
Boiling Point: 562.6±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 89.0±3.0 kJ/mol
Flash Point: 308.1±21.9 °C
Index of Refraction: 1.658
Molar Refractivity: 92.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.42
ACD/LogD (pH 5.5): 3.63
ACD/BCF (pH 5.5): 206.17
ACD/KOC (pH 5.5): 885.04
ACD/LogD (pH 7.4): 1.83
ACD/BCF (pH 7.4): 3.26
ACD/KOC (pH 7.4): 13.98
Polar Surface Area: 54 Å2
Polarizability: 36.5±0.5 10-24cm3
Surface Tension: 55.2±3.0 dyne/cm
Molar Volume: 249.8±3.0 cm3

Click to predict properties on the Chemicalize site






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