ChemSpider 2D Image | N-[(Allyloxy)carbonyl]-3-(3-pyridinyl)alanine | C12H14N2O4

N-[(Allyloxy)carbonyl]-3-(3-pyridinyl)alanine

  • Molecular FormulaC12H14N2O4
  • Average mass250.251 Da
  • Monoisotopic mass250.095352 Da
  • ChemSpider ID38241945

More details:

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

3-Pyridinepropanoic acid, α-[[(2-propen-1-yloxy)carbonyl]amino]- [ACD/Index Name]
N-[(Allyloxy)carbonyl]-3-(3-pyridinyl)alanin [German] [ACD/IUPAC Name]
N-[(Allyloxy)carbonyl]-3-(3-pyridinyl)alanine [ACD/IUPAC Name]
N-[(Allyloxy)carbonyl]-3-(3-pyridinyl)alanine [French] [ACD/IUPAC Name]
1008607-08-6 [RN]
3-Pyridinepropanoic acid, α-[[(2-propen-1-yloxy)carbonyl]amino]-
Allyloxycarbonyl-3-(3'-pyridyl)-DL-alanine
Aloc-b-(3-pyridyl)-DL-Ala-OH
MFCD06796725

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

Density: 1.2±0.1 g/cm3
Boiling Point: 458.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.8±3.0 kJ/mol
Flash Point: 231.2±28.7 °C
Index of Refraction: 1.548
Molar Refractivity: 63.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.07
ACD/LogD (pH 5.5): -1.72
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.93
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 89 Å2
Polarizability: 25.2±0.5 10-24cm3
Surface Tension: 51.9±3.0 dyne/cm
Molar Volume: 200.4±3.0 cm3

Click to predict properties on the Chemicalize site


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