ChemSpider 2D Image | Ethyl 4-{[5-(1-pyrrolidinylmethyl)-1H-tetrazol-1-yl]acetyl}-1-piperazinecarboxylate | C15H25N7O3

Ethyl 4-{[5-(1-pyrrolidinylmethyl)-1H-tetrazol-1-yl]acetyl}-1-piperazinecarboxylate

  • Molecular FormulaC15H25N7O3
  • Average mass351.404 Da
  • Monoisotopic mass351.201874 Da
  • ChemSpider ID23053708

More details:

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

1-Piperazinecarboxylic acid, 4-[2-[5-(1-pyrrolidinylmethyl)-1H-tetrazol-1-yl]acetyl]-, ethyl ester [ACD/Index Name]
4-{2-[5-(1-Pyrrolidinylméthyl)-1H-tétrazol-1-yl]acétyl}-1-pipérazinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-{[5-(1-pyrrolidinylmethyl)-1H-tetrazol-1-yl]acetyl}-1-piperazinecarboxylate [ACD/IUPAC Name]
Ethyl-4-{[5-(1-pyrrolidinylmethyl)-1H-tetrazol-1-yl]acetyl}-1-piperazincarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 589.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.0±3.0 kJ/mol
Flash Point: 310.5±30.1 °C
Index of Refraction: 1.670
Molar Refractivity: 91.9±0.5 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 0.62
ACD/LogD (pH 5.5): -2.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 8.55
Polar Surface Area: 97 Å2
Polarizability: 36.4±0.5 10-24cm3
Surface Tension: 61.1±7.0 dyne/cm
Molar Volume: 246.0±7.0 cm3

Click to predict properties on the Chemicalize site


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