ChemSpider 2D Image | 3-(1-(benzyloxycarbonyl)piperidin-3-yl)-3-oxopropanoic acid | C16H19NO5

3-(1-(benzyloxycarbonyl)piperidin-3-yl)-3-oxopropanoic acid

  • Molecular FormulaC16H19NO5
  • Average mass305.326 Da
  • Monoisotopic mass305.126312 Da
  • ChemSpider ID21373561

More details:

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

3-(1-(benzyloxycarbonyl)piperidin-3-yl)-3-oxopropanoic acid
3-(2-Carboxy-acetyl)-piperidine-1-carboxylic acid benzyl ester
3-{1-[(Benzyloxy)carbonyl]-3-piperidinyl}-3-oxopropanoic acid [ACD/IUPAC Name]
3-{1-[(Benzyloxy)carbonyl]-3-piperidinyl}-3-oxopropansäure [German] [ACD/IUPAC Name]
3-{1-[(Benzyloxy)carbonyl]piperidin-3-yl}-3-oxopropanoic acid
3-Piperidinepropanoic acid, β-oxo-1-[(phenylmethoxy)carbonyl]- [ACD/Index Name]
886362-40-9 [RN]
Acide 3-{1-[(benzyloxy)carbonyl]-3-pipéridinyl}-3-oxopropanoïque [French] [ACD/IUPAC Name]
β-Oxo-1-[(phenylmethoxy)carbonyl]-3-piperidinepropanoic acid
3-(1-((benzyloxy)carbonyl)piperidin-3-yl)-3-oxopropanoic acid

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


Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 502.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.2±3.0 kJ/mol
Flash Point: 257.7±30.1 °C
Index of Refraction: 1.564
Molar Refractivity: 77.5±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.64
ACD/LogD (pH 5.5): -0.33
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.54
ACD/LogD (pH 7.4): -1.71
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 84 Å2
Polarizability: 30.7±0.5 10-24cm3
Surface Tension: 56.1±3.0 dyne/cm
Molar Volume: 238.2±3.0 cm3

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