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Search term: DCZWLAKNYOFZPT-UHFFFAOYSA-N (Found by InChIKey (full match))

ChemSpider 2D Image | 1-[2-(4-{5-Butyl-4-[4-(4-chlorophenoxy)phenyl]-1,3-thiazol-2-yl}phenoxy)ethyl]-4-methylpiperazine | C32H36ClN3O2S

1-[2-(4-{5-Butyl-4-[4-(4-chlorophenoxy)phenyl]-1,3-thiazol-2-yl}phenoxy)ethyl]-4-methylpiperazine

  • Molecular FormulaC32H36ClN3O2S
  • Average mass562.165 Da
  • Monoisotopic mass561.221680 Da
  • ChemSpider ID28646749

More details:






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

1-[2-(4-{5-Butyl-4-[4-(4-chlorophenoxy)phenyl]-1,3-thiazol-2-yl}phenoxy)ethyl]-4-methylpiperazine [ACD/IUPAC Name]
1-[2-(4-{5-Butyl-4-[4-(4-chlorophénoxy)phényl]-1,3-thiazol-2-yl}phénoxy)éthyl]-4-méthylpipérazine [French] [ACD/IUPAC Name]
1-[2-(4-{5-Butyl-4-[4-(4-chlorphenoxy)phenyl]-1,3-thiazol-2-yl}phenoxy)ethyl]-4-methylpiperazin [German] [ACD/IUPAC Name]
Piperazine, 1-[2-[4-[5-butyl-4-[4-(4-chlorophenoxy)phenyl]-2-thiazolyl]phenoxy]ethyl]-4-methyl- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 697.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.1±3.0 kJ/mol
Flash Point: 375.5±34.3 °C
Index of Refraction: 1.594
Molar Refractivity: 161.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 8.58
ACD/LogD (pH 5.5): 5.11
ACD/BCF (pH 5.5): 1418.17
ACD/KOC (pH 5.5): 1599.25
ACD/LogD (pH 7.4): 6.77
ACD/BCF (pH 7.4): 64828.31
ACD/KOC (pH 7.4): 73105.94
Polar Surface Area: 66 Å2
Polarizability: 64.1±0.5 10-24cm3
Surface Tension: 46.0±3.0 dyne/cm
Molar Volume: 476.2±3.0 cm3

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