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1(2H)-Phthalazinone, 4-((4-chlorophenyl)methyl)-2-(1-(3-(3,4-dimethoxyphenyl)propyl)hexahydro-1H-azepin-4-yl)-, hydrochloride, hydrate (1:1:1)

Base Information
  • Chemical Name:1(2H)-Phthalazinone, 4-((4-chlorophenyl)methyl)-2-(1-(3-(3,4-dimethoxyphenyl)propyl)hexahydro-1H-azepin-4-yl)-, hydrochloride, hydrate (1:1:1)
  • CAS No.:110406-50-3
  • Molecular Formula:C32H36 Cl N3 O3 . Cl H
  • Molecular Weight:582.5605
  • Hs Code.:
  • DSSTox Substance ID:DTXSID20911649
  • Mol file:110406-50-3.mol
1(2H)-Phthalazinone, 4-((4-chlorophenyl)methyl)-2-(1-(3-(3,4-dimethoxyphenyl)propyl)hexahydro-1H-azepin-4-yl)-, hydrochloride, hydrate (1:1:1)

Synonyms:110406-50-3;1(2H)-Phthalazinone, 4-((4-chlorophenyl)methyl)-2-(1-(3-(3,4-dimethoxyphenyl)propyl)hexahydro-1H-azepin-4-yl)-, hydrochloride, hydrate (1:1:1);C32H36ClN3O3.ClH.H2O;DTXSID20911649;C32-H36-Cl-N3-O3.Cl-H.H2-O;LS-109205;4-[(4-Chlorophenyl)methyl]-2-{1-[3-(3,4-dimethoxyphenyl)propyl]azepan-4-yl}phthalazin-1(2H)-one--hydrogen chloride (1/1)

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Chemical Property of 1(2H)-Phthalazinone, 4-((4-chlorophenyl)methyl)-2-(1-(3-(3,4-dimethoxyphenyl)propyl)hexahydro-1H-azepin-4-yl)-, hydrochloride, hydrate (1:1:1)
Chemical Property:
  • Vapor Pressure:1E-18mmHg at 25°C 
  • Boiling Point:687°Cat760mmHg 
  • Flash Point:369.3°C 
  • Density:g/cm3 
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:5
  • Rotatable Bond Count:9
  • Exact Mass:581.2211974
  • Heavy Atom Count:40
  • Complexity:817
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MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:COC1=C(C=C(C=C1)CCCN2CCCC(CC2)N3C(=O)C4=CC=CC=C4C(=N3)CC5=CC=C(C=C5)Cl)OC.Cl
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