ChemSpider 2D Image | (~2~H_3_)Methyl 9-oxo-9H-xanthene-2-carboxylate | C15H7D3O4

(2H3)Methyl 9-oxo-9H-xanthene-2-carboxylate

  • Molecular FormulaC15H7D3O4
  • Average mass257.256 Da
  • Monoisotopic mass257.076752 Da
  • ChemSpider ID58780353

  • Non-standard isotope - Non-standard isotope

More details:

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

(2H3)Methyl 9-oxo-9H-xanthene-2-carboxylate [ACD/IUPAC Name]
(2H3)Methyl-9-oxo-9H-xanthen-2-carboxylat [German] [ACD/IUPAC Name]
9H-Xanthene-2-carboxylic acid, 9-oxo-, methyl-d3 ester [ACD/Index Name]
9-Oxo-9H-xanthène-2-carboxylate de (2H3)méthyle [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: 417.5±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.1±3.0 kJ/mol
Flash Point: 187.8±25.7 °C
Index of Refraction: 1.620
Molar Refractivity: 67.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.37
ACD/LogD (pH 5.5): 3.59
ACD/BCF (pH 5.5): 315.09
ACD/KOC (pH 5.5): 2137.88
ACD/LogD (pH 7.4): 3.59
ACD/BCF (pH 7.4): 315.09
ACD/KOC (pH 7.4): 2137.88
Polar Surface Area: 53 Å2
Polarizability: 26.7±0.5 10-24cm3
Surface Tension: 51.8±3.0 dyne/cm
Molar Volume: 191.5±3.0 cm3

Click to predict properties on the Chemicalize site


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