Found 3 results

Search term: ICAYNKLSQSKOJZ (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 1-(4-Fluorophenyl)-4-{4-[(R)-(4-fluorophenyl)(hydroxy)methyl]-1-piperidinyl}-1-butanone | C22H25F2NO2

1-(4-Fluorophenyl)-4-{4-[(R)-(4-fluorophenyl)(hydroxy)methyl]-1-piperidinyl}-1-butanone

  • Molecular FormulaC22H25F2NO2
  • Average mass373.436 Da
  • Monoisotopic mass373.185333 Da
  • ChemSpider ID34988729

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1-(4-Fluorophenyl)-4-{4-[(R)-(4-fluorophenyl)(hydroxy)methyl]-1-piperidinyl}-1-butanone [ACD/IUPAC Name]
1-(4-Fluorophényl)-4-{4-[(R)-(4-fluorophényl)(hydroxy)méthyl]-1-pipéridinyl}-1-butanone [French] [ACD/IUPAC Name]
1-(4-Fluorphenyl)-4-{4-[(R)-(4-fluorphenyl)(hydroxy)methyl]-1-piperidinyl}-1-butanon [German] [ACD/IUPAC Name]
1-Butanone, 1-(4-fluorophenyl)-4-[4-[(R)-(4-fluorophenyl)hydroxymethyl]-1-piperidinyl]- [ACD/Index Name]
38077-12-2 [RN]
Dihydrolenperone
UNII-9RJ5N8VE7Z

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

Density: 1.2±0.1 g/cm3
Boiling Point: 513.0±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.6±3.0 kJ/mol
Flash Point: 264.1±27.3 °C
Index of Refraction: 1.559
Molar Refractivity: 100.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.48
ACD/LogD (pH 5.5): 0.64
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.51
ACD/LogD (pH 7.4): 2.09
ACD/BCF (pH 7.4): 10.04
ACD/KOC (pH 7.4): 69.27
Polar Surface Area: 41 Å2
Polarizability: 40.0±0.5 10-24cm3
Surface Tension: 44.7±3.0 dyne/cm
Molar Volume: 312.5±3.0 cm3

Click to predict properties on the Chemicalize site


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