ChemSpider 2D Image | 1-{3-[5-({4-[(3-Chlorophenoxy)methyl]-4-hydroxy-1-piperidinyl}methyl)-2-methoxyphenoxy]propyl}-2-pyrrolidinone | C27H35ClN2O5

1-{3-[5-({4-[(3-Chlorophenoxy)methyl]-4-hydroxy-1-piperidinyl}methyl)-2-methoxyphenoxy]propyl}-2-pyrrolidinone

  • Molecular FormulaC27H35ClN2O5
  • Average mass503.030 Da
  • Monoisotopic mass502.223450 Da
  • ChemSpider ID68714425

More details:

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

1-{3-[5-({4-[(3-Chlorophenoxy)methyl]-4-hydroxy-1-piperidinyl}methyl)-2-methoxyphenoxy]propyl}-2-pyrrolidinone [ACD/IUPAC Name]
1-{3-[5-({4-[(3-Chlorophénoxy)méthyl]-4-hydroxy-1-pipéridinyl}méthyl)-2-méthoxyphénoxy]propyl}-2-pyrrolidinone [French] [ACD/IUPAC Name]
1-{3-[5-({4-[(3-Chlorphenoxy)methyl]-4-hydroxy-1-piperidinyl}methyl)-2-methoxyphenoxy]propyl}-2-pyrrolidinon [German] [ACD/IUPAC Name]
2-Pyrrolidinone, 1-[3-[5-[[4-[(3-chlorophenoxy)methyl]-4-hydroxy-1-piperidinyl]methyl]-2-methoxyphenoxy]propyl]- [ACD/Index Name]
1-[3-(5-{[4-(3-CHLOROPHENOXYMETHYL)-4-HYDROXYPIPERIDIN-1-YL]METHYL}-2-METHOXYPHENOXY)PROPYL]PYRROLIDIN-2-ONE
1-{3-[5-({4-[(3-CHLOROPHENOXY)METHYL]-4-HYDROXYPIPERIDIN-1-YL}METHYL)-2-METHOXYPHENOXY]PROPYL}PYRROLIDIN-2-ONE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 685.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 105.6±3.0 kJ/mol
Flash Point: 368.6±31.5 °C
Index of Refraction: 1.584
Molar Refractivity: 135.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 3.10
ACD/LogD (pH 5.5): 1.49
ACD/BCF (pH 5.5): 2.44
ACD/KOC (pH 5.5): 16.35
ACD/LogD (pH 7.4): 3.16
ACD/BCF (pH 7.4): 114.22
ACD/KOC (pH 7.4): 765.18
Polar Surface Area: 71 Å2
Polarizability: 53.9±0.5 10-24cm3
Surface Tension: 51.1±3.0 dyne/cm
Molar Volume: 406.0±3.0 cm3

Click to predict properties on the Chemicalize site


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