ChemSpider 2D Image | Ethyl 4-{2-[(2,2-dimethoxyethyl)amino]-3,4-dioxo-1-cyclobuten-1-yl}-1-piperazinecarboxylate | C15H23N3O6

Ethyl 4-{2-[(2,2-dimethoxyethyl)amino]-3,4-dioxo-1-cyclobuten-1-yl}-1-piperazinecarboxylate

  • Molecular FormulaC15H23N3O6
  • Average mass341.360 Da
  • Monoisotopic mass341.158691 Da
  • ChemSpider ID22470830

More details:

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

1-Piperazinecarboxylic acid, 4-[2-[(2,2-dimethoxyethyl)amino]-3,4-dioxo-1-cyclobuten-1-yl]-, ethyl ester [ACD/Index Name]
4-{2-[(2,2-Diméthoxyéthyl)amino]-3,4-dioxo-1-cyclobutén-1-yl}-1-pipérazinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-{2-[(2,2-dimethoxyethyl)amino]-3,4-dioxo-1-cyclobuten-1-yl}-1-piperazinecarboxylate [ACD/IUPAC Name]
Ethyl-4-{2-[(2,2-dimethoxyethyl)amino]-3,4-dioxo-1-cyclobuten-1-yl}-1-piperazincarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 457.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.8±3.0 kJ/mol
Flash Point: 230.7±31.5 °C
Index of Refraction: 1.553
Molar Refractivity: 83.8±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: -0.13
ACD/LogD (pH 5.5): 0.32
ACD/BCF (pH 5.5): 1.02
ACD/KOC (pH 5.5): 35.40
ACD/LogD (pH 7.4): 0.32
ACD/BCF (pH 7.4): 1.02
ACD/KOC (pH 7.4): 35.40
Polar Surface Area: 97 Å2
Polarizability: 33.2±0.5 10-24cm3
Surface Tension: 53.2±5.0 dyne/cm
Molar Volume: 261.9±5.0 cm3

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