ChemSpider 2D Image | 2-{4-[(tert-butoxy)carbonyl]-2-oxopiperazin-1-yl}propanoic acid | C12H20N2O5

2-{4-[(tert-butoxy)carbonyl]-2-oxopiperazin-1-yl}propanoic acid

  • Molecular FormulaC12H20N2O5
  • Average mass272.298 Da
  • Monoisotopic mass272.137207 Da
  • ChemSpider ID38003459

More details:

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

1448189-81-8 [RN]
1-Piperazineacetic acid, 4-[(1,1-dimethylethoxy)carbonyl]-α-methyl-2-oxo- [ACD/Index Name]
2-(4-{[(2-Methyl-2-propanyl)oxy]carbonyl}-2-oxo-1-piperazinyl)propanoic acid [ACD/IUPAC Name]
2-(4-{[(2-Methyl-2-propanyl)oxy]carbonyl}-2-oxo-1-piperazinyl)propansäure [German] [ACD/IUPAC Name]
2-{4-[(tert-butoxy)carbonyl]-2-oxopiperazin-1-yl}propanoic acid
Acide 2-(4-{[(2-méthyl-2-propanyl)oxy]carbonyl}-2-oxo-1-pipérazinyl)propanoïque [French] [ACD/IUPAC Name]
2-(4-(tert-butoxycarbonyl)-2-oxopiperazin-1-yl)propanoic acid
MFCD28965239

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

Density: 1.2±0.1 g/cm3
Boiling Point: 457.5±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 78.6±6.0 kJ/mol
Flash Point: 230.5±27.3 °C
Index of Refraction: 1.514
Molar Refractivity: 66.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.84
ACD/LogD (pH 5.5): -1.32
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.79
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 87 Å2
Polarizability: 26.1±0.5 10-24cm3
Surface Tension: 49.5±3.0 dyne/cm
Molar Volume: 219.0±3.0 cm3

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