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Technology Process of 5-(4-(4-Methoxyphenyl)-butylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl [German]

5-(4-(4-Methoxyphenyl)-butylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl [German]

Base Information
  • Chemical Name:5-(4-(4-Methoxyphenyl)-butylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl [German]
  • CAS No.:81786-52-9
  • Molecular Formula:C17H25ClN2O6
  • Molecular Weight:388.8432
  • Hs Code.:
  • DSSTox Substance ID:DTXSID701002216
5-(4-(4-Methoxyphenyl)-butylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl [German]

Synonyms:5-(4-(4-Methoxyphenyl)-butylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl [German];81786-52-9;L-Iditol, 1,4:3,6-dianhydro-2-deoxy-2-((4-(4-methoxyhenyl)butyl)amino)-, 5-nitrate, monohydrochloride;5-(4-(4-Methoxyphenyl)-butylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl;C17H24N2O6.ClH;DTXSID701002216;C17-H24-N2-O6.Cl-H;LS-77625;1,4:3,6-Dianhydro-2-deoxy-2-{[4-(4-methoxyphenyl)butyl]amino}-5-O-nitrohexitol--hydrogen chloride (1/1)

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Chemical Property of 5-(4-(4-Methoxyphenyl)-butylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat HCl [German]
Chemical Property:
  • Vapor Pressure:1.51E-10mmHg at 25°C 
  • Boiling Point:510.7°Cat760mmHg 
  • Flash Point:262.7°C 
  • Density:g/cm3 
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:7
  • Rotatable Bond Count:8
  • Exact Mass:388.1401142
  • Heavy Atom Count:26
  • Complexity:424
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MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:COC1=CC=C(C=C1)CCCCNC2COC3C2OCC3O[N+](=O)[O-].Cl
  • Isomeric SMILES:COC1=CC=C(C=C1)CCCCN[C@H]2CO[C@H]3[C@@H]2OC[C@@H]3O[N+](=O)[O-].Cl
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