ChemSpider 2D Image | N-Desmethylclozapine-d8 | C17H9D8ClN4

N-Desmethylclozapine-d8

  • Molecular FormulaC17H9D8ClN4
  • Average mass320.846 Da
  • Monoisotopic mass320.164398 Da
  • ChemSpider ID23935847

  • Non-standard isotope - Non-standard isotope

More details:

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

1189888-77-4 [RN]
5H-Dibenzo[b,e][1,4]diazepine, 8-chloro-11-(1-piperazinyl-2,2,3,3,5,5,6,6-d8)- [ACD/Index Name]
8-Chlor-11-[(2,2,3,3,5,5,6,6-2H8)-1-piperazinyl]-5H-dibenzo[b,e][1,4]diazepin [German] [ACD/IUPAC Name]
8-Chloro-11-[(2,2,3,3,5,5,6,6-2H8)-1-piperazinyl]-5H-dibenzo[b,e][1,4]diazepine [ACD/IUPAC Name]
8-Chloro-11-[(2,2,3,3,5,5,6,6-2H8)-1-pipérazinyl]-5H-dibenzo[b,e][1,4]diazépine [French] [ACD/IUPAC Name]
N-Desmethylclozapine-d8
6104-71-8 [RN]
labeled d8 desmethyl clozapine hydrochloride
MFCD09840368
N-DESMETHYL CLOZAPINE-D8

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 502.6±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 77.2±3.0 kJ/mol
    Flash Point: 257.7±32.9 °C
    Index of Refraction: 1.709
    Molar Refractivity: 88.4±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.97
    ACD/LogD (pH 5.5): -0.85
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 1.63
    ACD/BCF (pH 7.4): 5.29
    ACD/KOC (pH 7.4): 53.09
    Polar Surface Area: 40 Å2
    Polarizability: 35.0±0.5 10-24cm3
    Surface Tension: 54.0±7.0 dyne/cm
    Molar Volume: 226.4±7.0 cm3

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