ChemSpider 2D Image | 2-Oxo-1,3-propanediyl bis(2,4-dihydroxybenzoate) | C17H14O9

2-Oxo-1,3-propanediyl bis(2,4-dihydroxybenzoate)

  • Molecular FormulaC17H14O9
  • Average mass362.288 Da
  • Monoisotopic mass362.063782 Da
  • ChemSpider ID22018006

More details:

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

2-Oxo-1,3-propandiyl-bis(2,4-dihydroxybenzoat) [German] [ACD/IUPAC Name]
2-Oxo-1,3-propanediyl bis(2,4-dihydroxybenzoate) [ACD/IUPAC Name]
Benzoic acid, 2,4-dihydroxy-, 2-oxo-1,3-propanediyl ester [ACD/Index Name]
Bis(2,4-dihydroxybenzoate) de 2-oxo-1,3-propanediyle [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 721.6±49.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 109.2±3.0 kJ/mol
Flash Point: 266.4±23.3 °C
Index of Refraction: 1.660
Molar Refractivity: 86.2±0.3 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.06
ACD/LogD (pH 5.5): 3.24
ACD/BCF (pH 5.5): 168.41
ACD/KOC (pH 5.5): 1352.63
ACD/LogD (pH 7.4): 2.50
ACD/BCF (pH 7.4): 31.10
ACD/KOC (pH 7.4): 249.77
Polar Surface Area: 151 Å2
Polarizability: 34.2±0.5 10-24cm3
Surface Tension: 79.4±3.0 dyne/cm
Molar Volume: 233.5±3.0 cm3

Click to predict properties on the Chemicalize site


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