ChemSpider 2D Image | 4-{[(3R,4S)-4-(4-Fluorophenyl)-3-piperidinyl]methoxy}-2-methoxyphenol | C19H22FNO3

4-{[(3R,4S)-4-(4-Fluorophenyl)-3-piperidinyl]methoxy}-2-methoxyphenol

  • Molecular FormulaC19H22FNO3
  • Average mass331.381 Da
  • Monoisotopic mass331.158386 Da
  • ChemSpider ID32802618

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

4-{[(3R,4S)-4-(4-Fluorophenyl)-3-piperidinyl]methoxy}-2-methoxyphenol [ACD/IUPAC Name]
4-{[(3R,4S)-4-(4-Fluorophényl)-3-pipéridinyl]méthoxy}-2-méthoxyphénol [French] [ACD/IUPAC Name]
4-{[(3R,4S)-4-(4-Fluorphenyl)-3-piperidinyl]methoxy}-2-methoxyphenol [German] [ACD/IUPAC Name]
Phenol, 4-[[(3R,4S)-4-(4-fluorophenyl)-3-piperidinyl]methoxy]-2-methoxy- [ACD/Index Name]
(-)-trans-4-[4-(4'-Fluorophenyl)-3-piperidinylmethoxy]-2-methoxyphenol
112058-90-9 [RN]
4-(((3R,4S)-4-(4-fluoro-phenyl)piperidin-3-yl)methoxy)-2-methoxyphenol
MFCD09840631

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

Density: 1.2±0.1 g/cm3
Boiling Point: 488.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.3±3.0 kJ/mol
Flash Point: 249.1±28.7 °C
Index of Refraction: 1.552
Molar Refractivity: 90.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.79
ACD/LogD (pH 5.5): 0.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.89
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.17
Polar Surface Area: 51 Å2
Polarizability: 35.8±0.5 10-24cm3
Surface Tension: 42.4±3.0 dyne/cm
Molar Volume: 282.8±3.0 cm3

Click to predict properties on the Chemicalize site


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