ChemSpider 2D Image | 1-Boc-5-benzyl-4,5,6,7-tetrahydro-5-azaindole | C19H24N2O2

1-Boc-5-benzyl-4,5,6,7-tetrahydro-5-azaindole

  • Molecular FormulaC19H24N2O2
  • Average mass312.406 Da
  • Monoisotopic mass312.183777 Da
  • ChemSpider ID29364730

More details:






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

1427475-19-1 [RN]
1-Boc-5-benzyl-4,5,6,7-tetrahydro-5-azaindole
1H-Pyrrolo[3,2-c]pyridine-1-carboxylic acid, 4,5,6,7-tetrahydro-5-(phenylmethyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 5-benzyl-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-c]pyridine-1-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-5-benzyl-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-c]pyridin-1-carboxylat [German] [ACD/IUPAC Name]
5-Benzyl-4,5,6,7-tétrahydro-1H-pyrrolo[3,2-c]pyridine-1-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
(R)-nipecotamide
[1427475-19-1] [RN]
1-Boc-5-benzyl-4,5,6,7-tetrahydro-5-azaindole?
MFCD23381109 [MDL number]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 425.2±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.0±3.0 kJ/mol
Flash Point: 210.9±26.5 °C
Index of Refraction: 1.573
Molar Refractivity: 92.6±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.70
ACD/LogD (pH 5.5): 1.79
ACD/BCF (pH 5.5): 4.43
ACD/KOC (pH 5.5): 27.23
ACD/LogD (pH 7.4): 3.42
ACD/BCF (pH 7.4): 189.30
ACD/KOC (pH 7.4): 1162.18
Polar Surface Area: 34 Å2
Polarizability: 36.7±0.5 10-24cm3
Surface Tension: 40.5±7.0 dyne/cm
Molar Volume: 281.0±7.0 cm3

Click to predict properties on the Chemicalize site






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