Optochin dihydrochloride

Base Information

• Chemical Name: Optochin dihydrochloride
• CAS No.: 18984-77-5
• Molecular Formula: C21H30Cl2N2O2
• Molecular Weight: 413.3811
• DSSTox Substance ID: DTXSID50940508

Synonyms:Ethylhydrocupreine dihydrochloride;Optochin dihydrochloride;18984-77-5;Numoquin dihydrochloride;Optochin HCl;Hydrocupreine, O-ethyl-, dihydrochloride;Hydrocupreine ethyl ether, dihydrochloride;DTXSID50940508;6'-Ethoxy-10,11-dihydrocinchonan-9-ol--hydrogen chloride (1/2)

Chemical Property of Optochin dihydrochloride

Chemical Property:

• Boiling Point: 508.7°Cat760mmHg
• Flash Point: 261.5°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 412.1684336
• Heavy Atom Count: 27
• Complexity: 446

Purity/Quality:

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CCC1CN2CCC1CC2C(C3=C4C=C(C=CC4=NC=C3)OCC)O.Cl.Cl
• Isomeric SMILES: CC[C@H]1CN2CC[C@H]1C[C@H]2[C@@H](C3=C4C=C(C=CC4=NC=C3)OCC)O.Cl.Cl

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