ChemSpider 2D Image | Dimethyl 5-[(5,6-dihydro-1,4-dioxin-2-ylcarbonyl)amino]isophthalate | C15H15NO7

Dimethyl 5-[(5,6-dihydro-1,4-dioxin-2-ylcarbonyl)amino]isophthalate

  • Molecular FormulaC15H15NO7
  • Average mass321.282 Da
  • Monoisotopic mass321.084839 Da
  • ChemSpider ID22359480

More details:

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

1,3-Benzenedicarboxylic acid, 5-[[(5,6-dihydro-1,4-dioxin-2-yl)carbonyl]amino]-, dimethyl ester [ACD/Index Name]
5-[(5,6-Dihydro-1,4-dioxin-2-ylcarbonyl)amino]isophtalate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl 5-[(5,6-dihydro-1,4-dioxin-2-ylcarbonyl)amino]isophthalate [ACD/IUPAC Name]
Dimethyl-5-[(5,6-dihydro-1,4-dioxin-2-ylcarbonyl)amino]isophthalat [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 507.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.8±3.0 kJ/mol
Flash Point: 260.8±30.1 °C
Index of Refraction: 1.586
Molar Refractivity: 78.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.34
ACD/LogD (pH 5.5): 1.62
ACD/BCF (pH 5.5): 9.97
ACD/KOC (pH 5.5): 180.46
ACD/LogD (pH 7.4): 1.62
ACD/BCF (pH 7.4): 9.97
ACD/KOC (pH 7.4): 180.46
Polar Surface Area: 100 Å2
Polarizability: 31.1±0.5 10-24cm3
Surface Tension: 55.8±3.0 dyne/cm
Molar Volume: 234.2±3.0 cm3

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