ChemSpider 2D Image | Methyl 1-azabicyclo[2.2.1]heptane-4-carboxylate | C8H13NO2

Methyl 1-azabicyclo[2.2.1]heptane-4-carboxylate

  • Molecular FormulaC8H13NO2
  • Average mass155.194 Da
  • Monoisotopic mass155.094635 Da
  • ChemSpider ID23181070

More details:

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

1-Azabicyclo[2.2.1]heptane-4-carboxylate de méthyle [French] [ACD/IUPAC Name]
1-Azabicyclo[2.2.1]heptane-4-carboxylic acid, methyl ester [ACD/Index Name]
Methyl 1-azabicyclo[2.2.1]heptane-4-carboxylate [ACD/IUPAC Name]
Methyl-1-azabicyclo[2.2.1]heptan-4-carboxylat [German] [ACD/IUPAC Name]
119102-22-6 [RN]
1417546-08-7 [RN]
1-Azabicyclo[2.2.1]heptane-4-carboxylic acid [ACD/Index Name] [ACD/IUPAC Name]
1-Aza-bicyclo[2.2.1]heptane-4-carboxylic acid methyl ester
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL330709/
MFCD19199991

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

Density: 1.2±0.1 g/cm3
Boiling Point: 190.7±23.0 °C at 760 mmHg
Vapour Pressure: 0.5±0.4 mmHg at 25°C
Enthalpy of Vaporization: 42.7±3.0 kJ/mol
Flash Point: 73.2±13.5 °C
Index of Refraction: 1.520
Molar Refractivity: 40.7±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.55
ACD/LogD (pH 5.5): -2.27
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.03
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.04
Polar Surface Area: 30 Å2
Polarizability: 16.2±0.5 10-24cm3
Surface Tension: 41.2±5.0 dyne/cm
Molar Volume: 134.0±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement