ChemSpider 2D Image | Dimethyl 4,6-bis{4-[(2-methyl-2-propanyl)oxy]-4-oxobutoxy}isophthalate | C26H38O10

Dimethyl 4,6-bis{4-[(2-methyl-2-propanyl)oxy]-4-oxobutoxy}isophthalate

  • Molecular FormulaC26H38O10
  • Average mass510.574 Da
  • Monoisotopic mass510.246490 Da
  • ChemSpider ID9845431

More details:

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

1,3-Benzenedicarboxylic acid, 4,6-bis[4-(1,1-dimethylethoxy)-4-oxobutoxy]-, dimethyl ester [ACD/Index Name]
4,6-Bis{4-[(2-méthyl-2-propanyl)oxy]-4-oxobutoxy}isophtalate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl 4,6-bis{4-[(2-methyl-2-propanyl)oxy]-4-oxobutoxy}isophthalate [ACD/IUPAC Name]
Dimethyl-4,6-bis{4-[(2-methyl-2-propanyl)oxy]-4-oxobutoxy}isophthalat [German] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 582.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.1±3.0 kJ/mol
Flash Point: 244.5±30.2 °C
Index of Refraction: 1.494
Molar Refractivity: 131.5±0.3 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 3
ACD/LogP: 5.32
ACD/LogD (pH 5.5): 5.12
ACD/BCF (pH 5.5): 4565.47
ACD/KOC (pH 5.5): 14489.49
ACD/LogD (pH 7.4): 5.12
ACD/BCF (pH 7.4): 4565.47
ACD/KOC (pH 7.4): 14489.49
Polar Surface Area: 124 Å2
Polarizability: 52.1±0.5 10-24cm3
Surface Tension: 38.9±3.0 dyne/cm
Molar Volume: 451.4±3.0 cm3

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