Ethylmorphine hydrochloride dihydrate

Base Information

• Chemical Name: Ethylmorphine hydrochloride dihydrate
• CAS No.: 6746-59-4
• Molecular Formula: C19H23 N O3 . Cl H . 2 H2 O
• Molecular Weight: 385.93
• European Community (EC) Number: 686-160-8
• UNII: 407X3NQV4N
• DSSTox Substance ID: DTXSID90986728
• Wikidata: Q27258305
• NCI Thesaurus Code: C87358
• Mol file: 6746-59-4.mol

Synonyms:Ethylmorphine hydrochloride dihydrate;Dionin;Ethylmorphine HCl hydrate;6746-59-4;UNII-407X3NQV4N;407X3NQV4N;7,8-Didehydro-4,5-alpha-epoxy-3-ethoxy-17-methylmorphinan-6-alpha-ol hydrochloride dihydrate;Ethylmorphine hydrochloride hydrate;Morphinan-6-alpha-ol, 7,8-didehydro-4,5-alpha-epoxy-3-ethoxy-17-methyl-, hydrochloride, dihydrate;C19H23NO3.2H2O.HCl;C19H23NO3.ClH.2H2O;DTXSID90986728;CODETHYLINE HYDROCHLORIDE DIHYDRATE;LS-91903;ETHYLMORPHINE HYDROCHLORIDE HYDRATE [JAN];ETHYLMORPHINE HYDROCHLORIDE DIHYDRATE [MI];ETHYLMORPHINE HYDROCHLORIDE DIHYDRATE [WHO-DD];Q27258305;Ethylmorphine Hydrochloride, Dihydrate, (5alpha,6alpha)-Isomer;(5.ALPHA.,6.ALPHA.)-7,8-DIDEHYDRO-4,5-EPOXY-3-ETHOXY-17-METHYLMORPHINAN-6-OL HYDROCHLORIDE DIHYDRATE;Morphinan-6-alpha-ol, 7,8-didehydro-4,5-alpha-epoxy-3-ethoxy-17-methyl-, hydrochloride,dihydrate;Morphinan-6-ol, 7,8-didehydro-4,5-epoxy-3-ethoxy-17-methyl-, hydrochloride, dihydrate, (5.alpha.,6.alpha.)-;Morphinan-6.alpha.-ol, 7,8-didehydro-4,5.alpha.-epoxy-3-ethoxy-17-methyl-, hydrochloride, dihydrate

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Chemical Property of Ethylmorphine hydrochloride dihydrate

Chemical Property:

• Melting Point: about 123° (dec); mp about 170° (dec)
• Refractive Index: 1.6500 (estimate)
• PSA: 41.93000
• Density: 1.1309 (rough estimate)
• LogP: 1.82910
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 385.1656007
• Heavy Atom Count: 26
• Complexity: 523

Purity/Quality:

Safty Information:

• Safety Statements: Poison by subcutaneous route. Can be habit forming. An expe"> x and HCl. See also CODEINE and (−);MORPHINE." target="_blank">Poison by subcutaneous route. Can be habit forming. An expe

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC1=C2C3=C(CC4C5C3(CCN4C)C(O2)C(C=C5)O)C=C1.O.O.Cl
• Isomeric SMILES: CCOC1=C2C3=C(C[C@@H]4[C@H]5[C@]3(CCN4C)[C@@H](O2)[C@H](C=C5)O)C=C1.O.O.Cl