ChemSpider 2D Image | 1-(1,3-Benzodioxol-5-yl)-4-[(1S,2S)-2-{[(triisopropylsilyl)oxy]methyl}cyclopropyl]piperazine | C24H40N2O3Si

1-(1,3-Benzodioxol-5-yl)-4-[(1S,2S)-2-{[(triisopropylsilyl)oxy]methyl}cyclopropyl]piperazine

  • Molecular FormulaC24H40N2O3Si
  • Average mass432.672 Da
  • Monoisotopic mass432.280823 Da
  • ChemSpider ID75586243

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1-(1,3-Benzodioxol-5-yl)-4-[(1S,2S)-2-{[(triisopropylsilyl)oxy]methyl}cyclopropyl]piperazin [German] [ACD/IUPAC Name]
1-(1,3-Benzodioxol-5-yl)-4-[(1S,2S)-2-{[(triisopropylsilyl)oxy]methyl}cyclopropyl]piperazine [ACD/IUPAC Name]
1-(1,3-Benzodioxol-5-yl)-4-[(1S,2S)-2-{[(triisopropylsilyl)oxy]méthyl}cyclopropyl]pipérazine [French] [ACD/IUPAC Name]
Piperazine, 1-(1,3-benzodioxol-5-yl)-4-[(1S,2S)-2-[[[tris(1-methylethyl)silyl]oxy]methyl]cyclopropyl]- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 497.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.6±3.0 kJ/mol
Flash Point: 254.9±28.7 °C
Index of Refraction: 1.530
Molar Refractivity: 124.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.79
ACD/LogD (pH 5.5): 4.10
ACD/BCF (pH 5.5): 473.31
ACD/KOC (pH 5.5): 1612.62
ACD/LogD (pH 7.4): 4.94
ACD/BCF (pH 7.4): 3285.98
ACD/KOC (pH 7.4): 11195.75
Polar Surface Area: 34 Å2
Polarizability: 49.5±0.5 10-24cm3
Surface Tension: 37.1±3.0 dyne/cm
Molar Volume: 403.7±3.0 cm3

Click to predict properties on the Chemicalize site


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