ChemSpider 2D Image | (1R,3S)-1-Ethyl-3-[2-hydroxy(diphenyl)acetoxy]-1-methylpiperidinium | C22H28NO3

(1R,3S)-1-Ethyl-3-[2-hydroxy(diphenyl)acetoxy]-1-methylpiperidinium

  • Molecular FormulaC22H28NO3
  • Average mass354.462 Da
  • Monoisotopic mass354.206360 Da
  • ChemSpider ID34993706

  • Charge - Charge

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1R,3S)-1-Éthyl-3-(2-hydroxy-2,2-diphénylacétoxy)-1-méthylpipéridinium [French] [ACD/IUPAC Name]
(1R,3S)-1-Ethyl-3-[2-hydroxy(diphenyl)acetoxy]-1-methylpiperidinium [German] [ACD/IUPAC Name]
(1R,3S)-1-Ethyl-3-[2-hydroxy(diphenyl)acetoxy]-1-methylpiperidinium [ACD/IUPAC Name]
Piperidinium, 1-ethyl-3-[(2-hydroxy-2,2-diphenylacetyl)oxy]-1-methyl-, (1R,3S)- [ACD/Index Name]
[(1R,3R)-1-ethyl-1-methylpiperidin-1-ium-3-yl] 2-hydroxy-2,2-di(phenyl)acetate
[(1R,3R)-1-ethyl-1-methyl-piperidin-1-ium-3-yl] 2-hydroxy-2,2-di(phenyl)acetate
[(1R,3R)-1-ethyl-1-methyl-piperidin-1-ium-3-yl] 2-hydroxy-2,2-di(phenyl)ethanoate
13473-38-6 [RN]
236-748-1 [EINECS]
2-hydroxy-2,2-di(phenyl)acetic acid [(1R,3R)-1-ethyl-1-methyl-3-piperidin-1-iumyl] ester
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

NCGC00016378-01 [DBID]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.90
ACD/LogD (pH 5.5): -0.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.84
ACD/LogD (pH 7.4): -0.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 14.85
Polar Surface Area: 47 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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