ChemSpider 2D Image | 4-{2-[Benzyl(methyl)amino]ethyl}-1,2-phenylene bis(2-methylpropanoate) | C24H31NO4

4-{2-[Benzyl(methyl)amino]ethyl}-1,2-phenylene bis(2-methylpropanoate)

  • Molecular FormulaC24H31NO4
  • Average mass397.507 Da
  • Monoisotopic mass397.225311 Da
  • ChemSpider ID28534850

More details:

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

4-{2-[Benzyl(methyl)amino]ethyl}-1,2-phenylen-bis(2-methylpropanoat) [German] [ACD/IUPAC Name]
4-{2-[Benzyl(methyl)amino]ethyl}-1,2-phenylene bis(2-methylpropanoate) [ACD/IUPAC Name]
5-{2-[BENZYL(METHYL)AMINO]ETHYL}-2-[(2-METHYLPROPANOYL)OXY]PHENYL 2-METHYLPROPANOATE
96025-47-7 [RN]
Bis(2-méthylpropanoate) de 4-{2-[benzyl(méthyl)amino]éthyl}-1,2-phénylène [French] [ACD/IUPAC Name]
Propanoic acid, 2-methyl-, 4-[2-[methyl(phenylmethyl)amino]ethyl]-1,2-phenylene ester [ACD/Index Name]
4-(2-(Benzyl(methyl)amino)ethyl)-1,2-phenylene bis(2-methylpropanoate)
4-(2-(Benzyl(methyl)amino)ethyl)-1,2-phenylenebis(2-methylpropanoate)
4-{2-[BENZYL(METHYL)AMINO]ETHYL}-2-[(2-METHYLPROPANOYL)OXY]PHENYL 2-METHYLPROPANOATE
MFCD20260222 [MDL number]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 482.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.8±3.0 kJ/mol
Flash Point: 245.7±28.7 °C
Index of Refraction: 1.539
Molar Refractivity: 114.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 4.16
ACD/LogD (pH 5.5): 1.79
ACD/BCF (pH 5.5): 3.19
ACD/KOC (pH 5.5): 14.49
ACD/LogD (pH 7.4): 3.47
ACD/BCF (pH 7.4): 152.85
ACD/KOC (pH 7.4): 694.39
Polar Surface Area: 56 Å2
Polarizability: 45.4±0.5 10-24cm3
Surface Tension: 39.9±3.0 dyne/cm
Molar Volume: 365.3±3.0 cm3

Click to predict properties on the Chemicalize site


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