Bromocodeine

Base Information

• Chemical Name: Bromocodeine
• CAS No.: 49751-17-9
• Molecular Formula: C17H18BrNO3
• Molecular Weight: 364.2337
• DSSTox Substance ID: DTXSID20198014
• Nikkaji Number: J66.310G
• Wikidata: Q76309874
• Mol file: 49751-17-9.mol

Synonyms:Bromocodeine;Codeine, bromo-;BRN 6118169;49751-17-9;Morphinan-3,6-alpha-diol, 1-bromo-7,8-didehydro-4,5-alpha-epoxy-17-methyl-;2-27-00-00170 (Beilstein Handbook Reference);C17H18BrNO3;C17-H18-Br-N-O3;DTXSID20198014;LS-91726;1-Bromo-17-methyl-7,8-didehydro-4,5alpha-epoxymorphinan-3,6alpha-diol;Morphinan-3,6-diol, 1-bromo-7,8-didehydro-4,5-epoxy-17-methyl-, (5.alpha.,6.alpha.)-

Chemical Property of Bromocodeine

Chemical Property:

• Vapor Pressure: 2.29E-11mmHg at 25°C
• Boiling Point: 513.4°Cat760mmHg
• Flash Point: 264.3°C
• PSA: 52.93000
• Density: 1.73g/cm³
• LogP: 1.89850
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 363.04701
• Heavy Atom Count: 22
• Complexity: 528

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CCC23C4C1CC5=C(C=C(C(=C52)OC3C(C=C4)O)O)Br
• Isomeric SMILES: CN1CC[C@]23[C@@H]4[C@H]1CC5=C(C=C(C(=C52)O[C@H]3[C@H](C=C4)O)O)Br

Technology Process of Bromocodeine

There total 2 articles about Bromocodeine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 53.0%

morphine hydrochloride (52-26-6) → 1-Brommorphin (49751-17-9)

Guidance literature:

With bromine; acetic acid;

Reference yield:

→ 1-Brommorphin (49751-17-9)

Guidance literature:

With sodium methylate;

upstream raw materials:

morphine hydrochloride

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