ChemSpider 2D Image | 8-Chloro-11-[4-methyl(~2~H_8_)-1-piperazinyl]-10H-dibenzo[b,e][1,4]diazepine | C18H11D8ClN4

8-Chloro-11-[4-methyl(2H8)-1-piperazinyl]-10H-dibenzo[b,e][1,4]diazepine

  • Molecular FormulaC18H11D8ClN4
  • Average mass334.873 Da
  • Monoisotopic mass334.180023 Da
  • ChemSpider ID77494237
  • Non-standard isotope - Non-standard isotope


More details:






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

10H-Dibenzo[b,e][1,4]diazepine, 8-chloro-11-(4-methyl-1-piperazinyl-2,2,3,3,5,5,6,6-d8)- [ACD/Index Name]
8-Chlor-11-[4-methyl(2H8)-1-piperazinyl]-10H-dibenzo[b,e][1,4]diazepin [German] [ACD/IUPAC Name]
8-Chloro-11-[4-methyl(2H8)-1-piperazinyl]-10H-dibenzo[b,e][1,4]diazepine [ACD/IUPAC Name]
8-Chloro-11-[4-méthyl(2H8)-1-pipérazinyl]-10H-dibenzo[b,e][1,4]diazépine [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 477.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.2±3.0 kJ/mol
Flash Point: 242.8±28.7 °C
Index of Refraction: 1.681
Molar Refractivity: 93.7±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.72
ACD/LogD (pH 5.5): -0.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.89
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.62
Polar Surface Area: 31 Å2
Polarizability: 37.2±0.5 10-24cm3
Surface Tension: 50.1±7.0 dyne/cm
Molar Volume: 247.7±7.0 cm3

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