ChemSpider 2D Image | 5-{3-(3,5-Dicarboxyphenoxy)-2,2-bis[(3,5-dicarboxyphenoxy)methyl]propoxy}isophthalic acid | C37H28O20

5-{3-(3,5-Dicarboxyphenoxy)-2,2-bis[(3,5-dicarboxyphenoxy)methyl]propoxy}isophthalic acid

  • Molecular FormulaC37H28O20
  • Average mass792.606 Da
  • Monoisotopic mass792.117371 Da
  • ChemSpider ID26667113

More details:

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

5-{3-(3,5-Dicarboxyphenoxy)-2,2-bis[(3,5-dicarboxyphenoxy)methyl]propoxy}isophthalic acid [ACD/IUPAC Name]
5-{3-(3,5-Dicarboxyphenoxy)-2,2-bis[(3,5-dicarboxyphenoxy)methyl]propoxy}isophthalsäure [German] [ACD/IUPAC Name]
Acide 5-{3-(3,5-dicarboxyphénoxy)-2,2-bis[(3,5-dicarboxyphénoxy)méthyl]propoxy}isophtalique [French] [ACD/IUPAC Name]
5,5'-((2,2-Bis((3,5-dicarboxyphenoxy)methyl)propane-1,3-diyl)bis(oxy))diisophthalic acid
tetrakis[(3,5-dicarboxyphenoxy)methyl] methane
tetrakis[(3,5-dicarboxyphenoxy)methyl]methane

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

Density: 1.6±0.1 g/cm3
Boiling Point: 1192.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 185.1±3.0 kJ/mol
Flash Point: 370.2±27.8 °C
Index of Refraction: 1.691
Molar Refractivity: 185.6±0.3 cm3
#H bond acceptors: 20
#H bond donors: 8
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 4
ACD/LogP: 7.17
ACD/LogD (pH 5.5): -2.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 335 Å2
Polarizability: 73.6±0.5 10-24cm3
Surface Tension: 89.4±3.0 dyne/cm
Molar Volume: 484.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement