ChemSpider 2D Image | 1-[4-(4-Chloro-2-{[4-(methoxymethyl)-1-piperidinyl]carbonyl}phenoxy)-1-piperidinyl]ethanone | C21H29ClN2O4

1-[4-(4-Chloro-2-{[4-(methoxymethyl)-1-piperidinyl]carbonyl}phenoxy)-1-piperidinyl]ethanone

  • Molecular FormulaC21H29ClN2O4
  • Average mass408.919 Da
  • Monoisotopic mass408.181580 Da
  • ChemSpider ID22150843

More details:

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

1-[4-(4-Chlor-2-{[4-(methoxymethyl)-1-piperidinyl]carbonyl}phenoxy)-1-piperidinyl]ethanon [German] [ACD/IUPAC Name]
1-[4-(4-Chloro-2-{[4-(methoxymethyl)-1-piperidinyl]carbonyl}phenoxy)-1-piperidinyl]ethanone [ACD/IUPAC Name]
1-[4-(4-Chloro-2-{[4-(méthoxyméthyl)-1-pipéridinyl]carbonyl}phénoxy)-1-pipéridinyl]éthanone [French] [ACD/IUPAC Name]
Ethanone, 1-[4-[4-chloro-2-[[4-(methoxymethyl)-1-piperidinyl]carbonyl]phenoxy]-1-piperidinyl]- [ACD/Index Name]
1-(4-{4-CHLORO-2-[4-(METHOXYMETHYL)PIPERIDINE-1-CARBONYL]PHENOXY}PIPERIDIN-1-YL)ETHAN-1-ONE
1-(4-{4-CHLORO-2-[4-(METHOXYMETHYL)PIPERIDINE-1-CARBONYL]PHENOXY}PIPERIDIN-1-YL)ETHANONE
1-acetyl-4-(4-chloro-2-{[4-(methoxymethyl)-1-piperidinyl]carbonyl}phenoxy)piperidine

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

Density: 1.2±0.1 g/cm3
Boiling Point: 595.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.8±3.0 kJ/mol
Flash Point: 314.2±30.1 °C
Index of Refraction: 1.550
Molar Refractivity: 108.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.85
ACD/LogD (pH 5.5): 2.42
ACD/BCF (pH 5.5): 40.44
ACD/KOC (pH 5.5): 491.82
ACD/LogD (pH 7.4): 2.42
ACD/BCF (pH 7.4): 40.44
ACD/KOC (pH 7.4): 491.82
Polar Surface Area: 59 Å2
Polarizability: 42.9±0.5 10-24cm3
Surface Tension: 45.4±3.0 dyne/cm
Molar Volume: 339.2±3.0 cm3

Click to predict properties on the Chemicalize site


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