ChemSpider 2D Image | (4aS,7aR)-6-Methyloctahydro-1H-pyrrolo[3,4-b]pyridine | C8H16N2

(4aS,7aR)-6-Methyloctahydro-1H-pyrrolo[3,4-b]pyridine

  • Molecular FormulaC8H16N2
  • Average mass140.226 Da
  • Monoisotopic mass140.131348 Da
  • ChemSpider ID61400948

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(4aS,7aR)-6-Methyloctahydro-1H-pyrrolo[3,4-b]pyridin [German] [ACD/IUPAC Name]
(4aS,7aR)-6-Methyloctahydro-1H-pyrrolo[3,4-b]pyridine [ACD/IUPAC Name]
(4aS,7aR)-6-Méthyloctahydro-1H-pyrrolo[3,4-b]pyridine [French] [ACD/IUPAC Name]
1H-Pyrrolo[3,4-b]pyridine, octahydro-6-methyl-, (4aS,7aR)- [ACD/Index Name]
1932576-46-9 [RN]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 189.2±8.0 °C at 760 mmHg
Vapour Pressure: 0.6±0.4 mmHg at 25°C
Enthalpy of Vaporization: 42.5±3.0 kJ/mol
Flash Point: 69.2±9.4 °C
Index of Refraction: 1.480
Molar Refractivity: 42.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.63
ACD/LogD (pH 5.5): -3.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.60
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 15 Å2
Polarizability: 16.6±0.5 10-24cm3
Surface Tension: 28.6±3.0 dyne/cm
Molar Volume: 147.8±3.0 cm3

Click to predict properties on the Chemicalize site


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