ChemSpider 2D Image | 8-Chloro-10-{3-[4-methyl(~2~H_8_)-1-piperazinyl]propyl}-10H-phenothiazin-3-ol | C20H16D8ClN3OS

8-Chloro-10-{3-[4-methyl(2H8)-1-piperazinyl]propyl}-10H-phenothiazin-3-ol

  • Molecular FormulaC20H16D8ClN3OS
  • Average mass397.991 Da
  • Monoisotopic mass397.183075 Da
  • ChemSpider ID48060375

  • Non-standard isotope - Non-standard isotope

More details:

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

10H-Phenothiazin-3-ol, 8-chloro-10-[3-(4-methyl-1-piperazinyl-2,2,3,3,5,5,6,6-d8)propyl]- [ACD/Index Name]
8-Chlor-10-{3-[4-methyl(2H8)-1-piperazinyl]propyl}-10H-phenothiazin-3-ol [German] [ACD/IUPAC Name]
8-Chloro-10-{3-[4-methyl(2H8)-1-piperazinyl]propyl}-10H-phenothiazin-3-ol [ACD/IUPAC Name]
8-Chloro-10-{3-[4-méthyl(2H8)-1-pipérazinyl]propyl}-10H-phénothiazin-3-ol [French] [ACD/IUPAC Name]
1246819-57-7 [RN]
8-chloro-10-[3-(2,2,3,3,5,5,6,6-octadeuterio-4-methylpiperazin-1-yl)propyl]phenothiazin-3-ol

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

Density: 1.3±0.1 g/cm3
Boiling Point: 570.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.7±3.0 kJ/mol
Flash Point: 298.5±30.1 °C
Index of Refraction: 1.639
Molar Refractivity: 109.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.87
ACD/LogD (pH 5.5): 2.10
ACD/BCF (pH 5.5): 6.51
ACD/KOC (pH 5.5): 29.37
ACD/LogD (pH 7.4): 3.81
ACD/BCF (pH 7.4): 330.95
ACD/KOC (pH 7.4): 1492.12
Polar Surface Area: 55 Å2
Polarizability: 43.6±0.5 10-24cm3
Surface Tension: 51.6±3.0 dyne/cm
Molar Volume: 305.7±3.0 cm3

Click to predict properties on the Chemicalize site


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