ChemSpider 2D Image | Bicyclophenamine | C20H27NO2

Bicyclophenamine

  • Molecular FormulaC20H27NO2
  • Average mass313.434 Da
  • Monoisotopic mass313.204193 Da
  • ChemSpider ID32701273

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

(1S,4R)-2-Phénylbicyclo[2.2.1]heptane-2-carboxylate de 2-(1-pyrrolidinyl)éthyle [French] [ACD/IUPAC Name]
2-(1-Pyrrolidinyl)ethyl (1S,4R)-2-phenylbicyclo[2.2.1]heptane-2-carboxylate [ACD/IUPAC Name]
2-(1-Pyrrolidinyl)ethyl-(1S,4R)-2-phenylbicyclo[2.2.1]heptan-2-carboxylat [German] [ACD/IUPAC Name]
3570-06-7 [RN]
Bicyclo[2.2.1]heptane-2-carboxylic acid, 2-phenyl-, 2-(1-pyrrolidinyl)ethyl ester, (1S,4R)- [ACD/Index Name]
Bicyclophenamine
07/06/3570

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

UNII:V6Q7Q67304 [DBID]
V6Q7Q67304 [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 438.3±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.5±3.0 kJ/mol
Flash Point: 144.5±17.6 °C
Index of Refraction: 1.564
Molar Refractivity: 90.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.43
ACD/LogD (pH 5.5): 1.02
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.65
ACD/LogD (pH 7.4): 2.22
ACD/BCF (pH 7.4): 10.62
ACD/KOC (pH 7.4): 57.83
Polar Surface Area: 30 Å2
Polarizability: 35.8±0.5 10-24cm3
Surface Tension: 45.2±3.0 dyne/cm
Molar Volume: 277.7±3.0 cm3

Click to predict properties on the Chemicalize site


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