ChemSpider 2D Image | (R)-(-)-Calipamine | C12H19NO3

(R)-(-)-Calipamine

  • Molecular FormulaC12H19NO3
  • Average mass225.284 Da
  • Monoisotopic mass225.136490 Da
  • ChemSpider ID34983300

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(R)-(-)-Calipamine
(-)-Calipamine
(2R)-2-(3,4-Dimethoxyphenyl)-2-methoxy-N-methylethanamin [German] [ACD/IUPAC Name]
(2R)-2-(3,4-Dimethoxyphenyl)-2-methoxy-N-methylethanamine [ACD/IUPAC Name]
(2R)-2-(3,4-Diméthoxyphényl)-2-méthoxy-N-méthyléthanamine [French] [ACD/IUPAC Name]
(R)-Calipamine
Benzeneethanamine, β,3,4-trimethoxy-N-methyl-, (βR)- [ACD/Index Name]
Calipamine

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

Density: 1.0±0.1 g/cm3
Boiling Point: 305.2±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 54.6±3.0 kJ/mol
Flash Point: 127.6±17.3 °C
Index of Refraction: 1.494
Molar Refractivity: 63.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.35
ACD/LogD (pH 5.5): -1.44
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.03
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.63
Polar Surface Area: 40 Å2
Polarizability: 25.3±0.5 10-24cm3
Surface Tension: 32.4±3.0 dyne/cm
Molar Volume: 219.2±3.0 cm3

Click to predict properties on the Chemicalize site


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