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Search term: ATXRQOKSTOTYJH (Found by InChIKey (skeleton match))

ChemSpider 2D Image | Methyl 2-phenanthrenecarboxylate | C16H12O2

Methyl 2-phenanthrenecarboxylate

  • Molecular FormulaC16H12O2
  • Average mass236.265 Da
  • Monoisotopic mass236.083725 Da
  • ChemSpider ID24590167

More details:






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

2-Phénanthrènecarboxylate de méthyle [French] [ACD/IUPAC Name]
2-Phenanthrenecarboxylic acid, methyl ester [ACD/Index Name]
Methyl 2-phenanthrenecarboxylate [ACD/IUPAC Name]
Methyl-2-phenanthrencarboxylat [German] [ACD/IUPAC Name]
[25308-63-8]
25308-63-8 [RN]
2-Phenanthrenecarboxylic acid methyl ester
Methyl phenanthrene-2-carboxylate
methylphenanthrene-2-carboxylate
MFCD13191755 [MDL number]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 405.4±14.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.7±3.0 kJ/mol
Flash Point: 194.3±4.9 °C
Index of Refraction: 1.678
Molar Refractivity: 73.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.66
ACD/LogD (pH 5.5): 4.76
ACD/BCF (pH 5.5): 2444.55
ACD/KOC (pH 5.5): 9265.49
ACD/LogD (pH 7.4): 4.76
ACD/BCF (pH 7.4): 2444.55
ACD/KOC (pH 7.4): 9265.49
Polar Surface Area: 26 Å2
Polarizability: 29.2±0.5 10-24cm3
Surface Tension: 49.9±3.0 dyne/cm
Molar Volume: 195.6±3.0 cm3

Click to predict properties on the Chemicalize site






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