ChemSpider 2D Image | 1,3-bis-[3,5-bis(carboxy)phenoxy]propane | C19H16O10

1,3-bis-[3,5-bis(carboxy)phenoxy]propane

  • Molecular FormulaC19H16O10
  • Average mass404.324 Da
  • Monoisotopic mass404.074341 Da
  • ChemSpider ID24770585

More details:

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

1,3-Benzenedicarboxylic acid, 5,5'-[1,3-propanediylbis(oxy)]bis- [ACD/Index Name]
1,3-bis-[3,5-bis(carboxy)phenoxy]propane
5,5'-[1,3-Propandiylbis(oxy)]diisophthalsäure [German] [ACD/IUPAC Name]
5,5'-[1,3-Propanediylbis(oxy)]diisophthalic acid [ACD/IUPAC Name]
Acide 5,5'-[1,3-propanediylbis(oxy)]diisophtalique [French] [ACD/IUPAC Name]
433216-78-5 [RN]
5-[3-(3,5-dicarboxyphenoxy)propoxy]benzene-1,3-dicarboxylic acid

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

Density: 1.5±0.1 g/cm3
Boiling Point: 762.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 116.5±3.0 kJ/mol
Flash Point: 274.6±26.4 °C
Index of Refraction: 1.646
Molar Refractivity: 96.2±0.3 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 3.98
ACD/LogD (pH 5.5): -1.81
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.37
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 168 Å2
Polarizability: 38.1±0.5 10-24cm3
Surface Tension: 76.7±3.0 dyne/cm
Molar Volume: 265.0±3.0 cm3

Click to predict properties on the Chemicalize site


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