ChemSpider 2D Image | 2-Methyl-2-propanyl 2-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)oxy]-4-methylpentanoate | C18H23NO5

2-Methyl-2-propanyl 2-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)oxy]-4-methylpentanoate

  • Molecular FormulaC18H23NO5
  • Average mass333.379 Da
  • Monoisotopic mass333.157623 Da
  • ChemSpider ID57441576

More details:

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

2-[(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)oxy]-4-méthylpentanoate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl 2-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)oxy]-4-methylpentanoate [ACD/IUPAC Name]
2-Methyl-2-propanyl-2-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)oxy]-4-methylpentanoat [German] [ACD/IUPAC Name]
Pentanoic acid, 2-[(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)oxy]-4-methyl-, 1,1-dimethylethyl ester [ACD/Index Name]
Pentanoic acid, 2-[(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)oxy]-4-methyl-, 1,1-dimethylethyl ester, (2R)- [ACD/Index Name]
TERT-BUTYL 2-[(1,3-DIOXOISOINDOL-2-YL)OXY]-4-METHYLPENTANOATE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 430.0±47.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.5±3.0 kJ/mol
Flash Point: 213.9±29.3 °C
Index of Refraction: 1.544
Molar Refractivity: 87.9±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.09
ACD/LogD (pH 5.5): 3.51
ACD/BCF (pH 5.5): 273.23
ACD/KOC (pH 5.5): 1930.49
ACD/LogD (pH 7.4): 3.51
ACD/BCF (pH 7.4): 273.23
ACD/KOC (pH 7.4): 1930.49
Polar Surface Area: 73 Å2
Polarizability: 34.9±0.5 10-24cm3
Surface Tension: 46.5±5.0 dyne/cm
Molar Volume: 278.7±5.0 cm3

Click to predict properties on the Chemicalize site


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