ChemSpider 2D Image | Ethyl 5-benzyl-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-c]pyridine-2-carboxylate | C17H20N2O2

Ethyl 5-benzyl-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-c]pyridine-2-carboxylate

  • Molecular FormulaC17H20N2O2
  • Average mass284.353 Da
  • Monoisotopic mass284.152466 Da
  • ChemSpider ID23346481

More details:

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

1201784-83-9 [RN]
1H-Pyrrolo[3,2-c]pyridine-2-carboxylic acid, 4,5,6,7-tetrahydro-5-(phenylmethyl)-, ethyl ester [ACD/Index Name]
5-Benzyl-4,5,6,7-tétrahydro-1H-pyrrolo[3,2-c]pyridine-2-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4,5,6,7-tetrahydro-5-(phenylmethyl)-1H-pyrrolo[3,2-c]pyridine-2-carboxylate
Ethyl 5-benzyl-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-c]pyridine-2-carboxylate [ACD/IUPAC Name]
Ethyl-5-benzyl-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-c]pyridin-2-carboxylat [German] [ACD/IUPAC Name]
916420-29-6 [RN]
ethyl5-benzyl-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-c]pyridine-2-carboxylate
ethyl-5-benzyl-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-c]pyridine-2-carboxylate
MFCD11616513

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

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

Density: 1.2±0.1 g/cm3
Boiling Point: 464.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.5±3.0 kJ/mol
Flash Point: 234.4±28.7 °C
Index of Refraction: 1.604
Molar Refractivity: 82.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.01
ACD/LogD (pH 5.5): 1.32
ACD/BCF (pH 5.5): 1.58
ACD/KOC (pH 5.5): 10.07
ACD/LogD (pH 7.4): 3.03
ACD/BCF (pH 7.4): 80.83
ACD/KOC (pH 7.4): 514.29
Polar Surface Area: 45 Å2
Polarizability: 32.5±0.5 10-24cm3
Surface Tension: 51.4±3.0 dyne/cm
Molar Volume: 238.3±3.0 cm3

Click to predict properties on the Chemicalize site


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