ChemSpider 2D Image | Ethyl 4-({2-[(3-isopropoxypropyl)amino]-3,4-dioxo-1-cyclobuten-1-yl}amino)-1-piperidinecarboxylate | C18H29N3O5

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

  • Molecular FormulaC18H29N3O5
  • Average mass367.440 Da
  • Monoisotopic mass367.210724 Da
  • ChemSpider ID21905697

More details:

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

1-Piperidinecarboxylic acid, 4-[[2-[[3-(1-methylethoxy)propyl]amino]-3,4-dioxo-1-cyclobuten-1-yl]amino]-, ethyl ester [ACD/Index Name]
4-({2-[(3-Isopropoxypropyl)amino]-3,4-dioxo-1-cyclobutén-1-yl}amino)-1-pipéridinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-({2-[(3-isopropoxypropyl)amino]-3,4-dioxo-1-cyclobuten-1-yl}amino)-1-piperidinecarboxylate [ACD/IUPAC Name]
Ethyl-4-({2-[(3-isopropoxypropyl)amino]-3,4-dioxo-1-cyclobuten-1-yl}amino)-1-piperidincarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 493.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.1±3.0 kJ/mol
Flash Point: 252.2±31.5 °C
Index of Refraction: 1.538
Molar Refractivity: 95.7±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 0.01
ACD/LogD (pH 5.5): 1.11
ACD/BCF (pH 5.5): 4.12
ACD/KOC (pH 5.5): 95.88
ACD/LogD (pH 7.4): 1.11
ACD/BCF (pH 7.4): 4.12
ACD/KOC (pH 7.4): 95.88
Polar Surface Area: 97 Å2
Polarizability: 38.0±0.5 10-24cm3
Surface Tension: 48.3±5.0 dyne/cm
Molar Volume: 306.2±5.0 cm3

Click to predict properties on the Chemicalize site


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