ChemSpider 2D Image | tert-butyl 4-(2-methoxy-2-oxoethyl)piperazine-1-carboxylate | C12H22N2O4

tert-butyl 4-(2-methoxy-2-oxoethyl)piperazine-1-carboxylate

  • Molecular FormulaC12H22N2O4
  • Average mass258.314 Da
  • Monoisotopic mass258.157959 Da
  • ChemSpider ID23082612

More details:

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

1-Piperazineacetic acid, 4-[(1,1-dimethylethoxy)carbonyl]-, methyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-(2-methoxy-2-oxoethyl)-1-piperazinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-(2-methoxy-2-oxoethyl)-1-piperazincarboxylat [German] [ACD/IUPAC Name]
4-(2-Méthoxy-2-oxoéthyl)-1-pipérazinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
731810-20-1 [RN]
tert-butyl 4-(2-methoxy-2-oxoethyl)piperazine-1-carboxylate
tert-Butyl 4-(2-methoxy-2-oxoethyl)-piperazine-1-carboxylate
[731810-20-1] [RN]
1-Boc-4-Methoxycarbonylmethyl piperazine
1-piperazineacetic acid, 4-[(1,1-dimethylethoxy)carbonyl], methyl ester
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 330.4±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 57.3±3.0 kJ/mol
    Flash Point: 153.6±26.5 °C
    Index of Refraction: 1.479
    Molar Refractivity: 66.1±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 1.38
    ACD/LogD (pH 5.5): 1.42
    ACD/BCF (pH 5.5): 7.00
    ACD/KOC (pH 5.5): 137.68
    ACD/LogD (pH 7.4): 1.45
    ACD/BCF (pH 7.4): 7.45
    ACD/KOC (pH 7.4): 146.55
    Polar Surface Area: 59 Å2
    Polarizability: 26.2±0.5 10-24cm3
    Surface Tension: 38.5±3.0 dyne/cm
    Molar Volume: 233.3±3.0 cm3

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