ChemSpider 2D Image | Dimethyl 5-{[N-(methoxycarbonyl)-N-methylglycyl]oxy}isophthalate | C15H17NO8

Dimethyl 5-{[N-(methoxycarbonyl)-N-methylglycyl]oxy}isophthalate

  • Molecular FormulaC15H17NO8
  • Average mass339.297 Da
  • Monoisotopic mass339.095428 Da
  • ChemSpider ID29835096

More details:

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

1,3-Benzenedicarboxylic acid, 5-[[2-[(methoxycarbonyl)methylamino]acetyl]oxy]-, dimethyl ester [ACD/Index Name]
5-{[N-(Méthoxycarbonyl)-N-méthylglycyl]oxy}isophtalate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl 5-{[N-(methoxycarbonyl)-N-methylglycyl]oxy}isophthalate [ACD/IUPAC Name]
Dimethyl-5-{[N-(methoxycarbonyl)-N-methylglycyl]oxy}isophthalat [German] [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: 469.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.2±3.0 kJ/mol
Flash Point: 237.9±28.7 °C
Index of Refraction: 1.524
Molar Refractivity: 80.5±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 2.59
ACD/LogD (pH 5.5): 2.07
ACD/BCF (pH 5.5): 21.83
ACD/KOC (pH 5.5): 316.30
ACD/LogD (pH 7.4): 2.07
ACD/BCF (pH 7.4): 21.83
ACD/KOC (pH 7.4): 316.30
Polar Surface Area: 108 Å2
Polarizability: 31.9±0.5 10-24cm3
Surface Tension: 46.8±3.0 dyne/cm
Molar Volume: 263.1±3.0 cm3

Click to predict properties on the Chemicalize site


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