ChemSpider 2D Image | (1R,2S)-2-(3,4-Dimethoxybenzyl)cyclopentanamine | C14H21NO2

(1R,2S)-2-(3,4-Dimethoxybenzyl)cyclopentanamine

  • Molecular FormulaC14H21NO2
  • Average mass235.322 Da
  • Monoisotopic mass235.157227 Da
  • ChemSpider ID23166193

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1R,2S)-2-(3,4-Dimethoxybenzyl)cyclopentanamin [German] [ACD/IUPAC Name]
(1R,2S)-2-(3,4-Dimethoxybenzyl)cyclopentanamine [ACD/IUPAC Name]
(1R,2S)-2-(3,4-Diméthoxybenzyl)cyclopentanamine [French] [ACD/IUPAC Name]
Cyclopentanamine, 2-[(3,4-dimethoxyphenyl)methyl]-, (1R,2S)- [ACD/Index Name]
(1R,2S)-2-(3,4-Dimethoxy-benzyl)-cyclopentylamine

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

Density: 1.1±0.1 g/cm3
Boiling Point: 342.1±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.6±3.0 kJ/mol
Flash Point: 176.2±29.6 °C
Index of Refraction: 1.533
Molar Refractivity: 69.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.55
ACD/LogD (pH 5.5): -1.03
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.81
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 44 Å2
Polarizability: 27.4±0.5 10-24cm3
Surface Tension: 38.5±3.0 dyne/cm
Molar Volume: 222.6±3.0 cm3

Click to predict properties on the Chemicalize site


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