ChemSpider 2D Image | Ethyl 1-benzyl-1,2,5,6-tetrahydro-3-pyridinecarboxylate | C15H19NO2

Ethyl 1-benzyl-1,2,5,6-tetrahydro-3-pyridinecarboxylate

  • Molecular FormulaC15H19NO2
  • Average mass245.317 Da
  • Monoisotopic mass245.141586 Da
  • ChemSpider ID24765390

More details:






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

1-Benzyl-1,2,5,6-tétrahydro-3-pyridinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
3-Pyridinecarboxylic acid, 1,2,5,6-tetrahydro-1-(phenylmethyl)-, ethyl ester [ACD/Index Name]
Ethyl 1-benzyl-1,2,5,6-tetrahydro-3-pyridinecarboxylate [ACD/IUPAC Name]
Ethyl-1-benzyl-1,2,5,6-tetrahydro-3-pyridincarboxylat [German] [ACD/IUPAC Name]
[1159982-41-8]
1159982-41-8 [RN]
115998-24-8 [RN]
1260895-14-4 [RN]
Ethyl 1-benzyl-1,2,5,6-tetrahydropyridine-3-carboxylate
ethyl 1-benzyl-3,6-dihydro-2H-pyridine-5-carboxylate
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 343.0±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 58.7±3.0 kJ/mol
Flash Point: 120.9±15.4 °C
Index of Refraction: 1.555
Molar Refractivity: 71.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.33
ACD/LogD (pH 5.5): 1.58
ACD/BCF (pH 5.5): 4.14
ACD/KOC (pH 5.5): 36.75
ACD/LogD (pH 7.4): 2.91
ACD/BCF (pH 7.4): 89.64
ACD/KOC (pH 7.4): 795.22
Polar Surface Area: 30 Å2
Polarizability: 28.1±0.5 10-24cm3
Surface Tension: 44.2±3.0 dyne/cm
Molar Volume: 221.2±3.0 cm3

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