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Search term: 78436014 (Found by CSID)
ChemSpider 2D Image | 3-Hydroxy-1-methyl-3-{4-[(3-methyl-2-buten-1-yl)oxy]benzyl}-2,5-piperazinedione | C17H22N2O4

3-Hydroxy-1-methyl-3-{4-[(3-methyl-2-buten-1-yl)oxy]benzyl}-2,5-piperazinedione

  • Molecular FormulaC17H22N2O4
  • Average mass318.368 Da
  • Monoisotopic mass318.157959 Da
  • ChemSpider ID78436014

More details:

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

2,5-Piperazinedione, 3-hydroxy-1-methyl-3-[[4-[(3-methyl-2-buten-1-yl)oxy]phenyl]methyl]- [ACD/Index Name]
3-Hydroxy-1-methyl-3-{4-[(3-methyl-2-buten-1-yl)oxy]benzyl}-2,5-piperazindion [German] [ACD/IUPAC Name]
3-Hydroxy-1-methyl-3-{4-[(3-methyl-2-buten-1-yl)oxy]benzyl}-2,5-piperazinedione [ACD/IUPAC Name]
3-Hydroxy-1-méthyl-3-{4-[(3-méthyl-2-butén-1-yl)oxy]benzyl}-2,5-pipérazinedione [French] [ACD/IUPAC Name]
Fusaperazine C

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

Density: 1.2±0.1 g/cm3
Boiling Point: 591.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 92.8±3.0 kJ/mol
Flash Point: 311.6±30.1 °C
Index of Refraction: 1.567
Molar Refractivity: 86.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.74
ACD/LogD (pH 5.5): 1.02
ACD/BCF (pH 5.5): 3.54
ACD/KOC (pH 5.5): 86.04
ACD/LogD (pH 7.4): 1.02
ACD/BCF (pH 7.4): 3.54
ACD/KOC (pH 7.4): 86.02
Polar Surface Area: 79 Å2
Polarizability: 34.1±0.5 10-24cm3
Surface Tension: 48.4±3.0 dyne/cm
Molar Volume: 263.7±3.0 cm3

Click to predict properties on the Chemicalize site


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