ChemSpider 2D Image | tert-butyl 4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)-2-methylpiperazine-1-carboxylate | C19H26N2O5

tert-butyl 4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)-2-methylpiperazine-1-carboxylate

  • Molecular FormulaC19H26N2O5
  • Average mass362.420 Da
  • Monoisotopic mass362.184174 Da
  • ChemSpider ID28539312

More details:

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

1353978-12-7 [RN]
1-Piperazinecarboxylic acid, 4-[(2,3-dihydro-1,4-benzodioxin-2-yl)carbonyl]-2-methyl-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)-2-methyl-1-piperazinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)-2-methyl-1-piperazincarboxylat [German] [ACD/IUPAC Name]
4-(2,3-Dihydro-1,4-benzodioxin-2-ylcarbonyl)-2-méthyl-1-pipérazinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
tert-butyl 4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)-2-methylpiperazine-1-carboxylate
2-Methyl-4-(2,3,4a,8a-tetrahydro-benzo[1,4]dioxine-2-carbonyl)-piperazine-1-carboxylic acid tert-butyl ester
4-(2,3-Dihydrobenzo[1,4]dioxine-2-carbonyl)-2-methylpiperazine-1-carboxylic acid tert-butyl ester
4-(2,3-Dihydro-benzo[1,4]dioxine-2-carbonyl)-2-methylpiperazine-1-carboxylic acid tert-butyl ester
4-(2,3-Dihydro-benzo[1,4]dioxine-2-carbonyl)-2-methyl-piperazine-1-carboxylic acid tert-butyl ester
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 505.2±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 77.5±3.0 kJ/mol
    Flash Point: 259.3±30.1 °C
    Index of Refraction: 1.541
    Molar Refractivity: 94.7±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.19
    ACD/LogD (pH 5.5): 2.87
    ACD/BCF (pH 5.5): 89.49
    ACD/KOC (pH 5.5): 868.36
    ACD/LogD (pH 7.4): 2.87
    ACD/BCF (pH 7.4): 89.49
    ACD/KOC (pH 7.4): 868.36
    Polar Surface Area: 68 Å2
    Polarizability: 37.5±0.5 10-24cm3
    Surface Tension: 44.8±3.0 dyne/cm
    Molar Volume: 301.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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