ChemSpider 2D Image | 1-BOC-3-[(4-METHYL-PIPERAZIN-1-YLETHYL)-AMINO]-PYRROLIDINE | C16H32N4O2

1-BOC-3-[(4-METHYL-PIPERAZIN-1-YLETHYL)-AMINO]-PYRROLIDINE

  • Molecular FormulaC16H32N4O2
  • Average mass312.451 Da
  • Monoisotopic mass312.252533 Da
  • ChemSpider ID28552154

More details:

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

1-BOC-3-[(4-METHYL-PIPERAZIN-1-YLETHYL)-AMINO]-PYRROLIDINE
1-Pyrrolidinecarboxylic acid, 3-[[2-(4-methyl-1-piperazinyl)ethyl]amino]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 3-{[2-(4-methyl-1-piperazinyl)ethyl]amino}-1-pyrrolidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-3-{[2-(4-methyl-1-piperazinyl)ethyl]amino}-1-pyrrolidincarboxylat [German] [ACD/IUPAC Name]
3-{[2-(4-Méthyl-1-pipérazinyl)éthyl]amino}-1-pyrrolidinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
887579-14-8 [RN]
1-boc-3-[(4-methylpiperazin-1-ylethyl)amino]pyrrolidine
1-boc-3-[(4-methylpiperazin-1-ylethyl)-amino]pyrrolidine
1-PYRROLIDINECARBOXYLICACID, 3-[[2-(4-METHYL-1-PIPERAZINYL)ETHYL]AMINO]-, 1,1-DIMETHYLETHYL ESTER
MFCD07785926
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 419.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.3±3.0 kJ/mol
Flash Point: 207.3±28.7 °C
Index of Refraction: 1.536
Molar Refractivity: 89.2±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.01
ACD/LogD (pH 5.5): -3.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.34
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.44
Polar Surface Area: 48 Å2
Polarizability: 35.4±0.5 10-24cm3
Surface Tension: 44.6±5.0 dyne/cm
Molar Volume: 285.9±5.0 cm3

Click to predict properties on the Chemicalize site


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