Morphinan-6-one, 7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-14-[[(2E)-3-phenyl-2-propenyl]oxy]-, (5alpha)-

Base Information

Chemical Name:Morphinan-6-one, 7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-14-[[(2E)-3-phenyl-2-propenyl]oxy]-, (5alpha)-
CAS No.:528854-52-6
Molecular Formula:C₂₇H₂₇NO₄
Molecular Weight:429.516
Hs Code.:
DSSTox Substance ID:DTXSID101112120

Synonyms:SCHEMBL4632966;DTXSID101112120;528854-52-6;Morphinan-6-one, 7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-14-[[(2E)-3-phenyl-2-propenyl]oxy]-, (5alpha)-

Suppliers and Price of Morphinan-6-one, 7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-14-[[(2E)-3-phenyl-2-propenyl]oxy]-, (5alpha)-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of Morphinan-6-one, 7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-14-[[(2E)-3-phenyl-2-propenyl]oxy]-, (5alpha)-

Chemical Property:

XLogP3:3.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:429.19400834
Heavy Atom Count:32
Complexity:804

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CN1CCC23C4C(=O)C=CC2(C1CC5=C3C(=C(C=C5)OC)O4)OCC=CC6=CC=CC=C6
Isomeric SMILES:CN1CC[C@]23[C@@H]4C(=O)C=C[C@]2([C@H]1CC5=C3C(=C(C=C5)OC)O4)OC/C=C/C6=CC=CC=C6

Technology Process of Morphinan-6-one, 7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-14-[[(2E)-3-phenyl-2-propenyl]oxy]-, (5alpha)-

There total 2 articles about Morphinan-6-one, 7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-14-[[(2E)-3-phenyl-2-propenyl]oxy]-, (5alpha)- 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: 60.0%

: 508-54-3
14-hydroxycodeinone

: 4392-24-9
Cinnamyl bromide

: 528854-52-6
7,8-didehydro-4,5α-epoxy-3-methoxy-17-methyl-14β-{[(E)-3-phenylprop-2-enyl]oxy}morphinan-6-one

Guidance literature:: 14-hydroxycodeinone; With sodium hydride; In N,N-dimethyl-formamide; at 0 ℃; for 0.333333h;

Cinnamyl bromide; In N,N-dimethyl-formamide; at 0 ℃; for 5h;

Reference yield:

: 508-54-3
14-hydroxycodeinone

: 4392-24-9
3-bromo-1-phenyl-1-propenyl bromide

: 14-(Z)-cinnamyloxycodeinone

: 528854-52-6
7,8-didehydro-4,5α-epoxy-3-methoxy-17-methyl-14β-{[(E)-3-phenylprop-2-enyl]oxy}morphinan-6-one

Guidance literature:: 14-hydroxycodeinone; With sodium hydride; In N,N-dimethyl-formamide; at 5 ℃; for 0.333333h;

3-bromo-1-phenyl-1-propenyl bromide; In N,N-dimethyl-formamide; at 5 - 20 ℃; for 5h; Title compound not separated from byproducts;
DOI:10.1021/jm021118o

Reference yield: 79.0%

: 528854-52-6
7,8-didehydro-4,5α-epoxy-3-methoxy-17-methyl-14β-{[(E)-3-phenylprop-2-enyl]oxy}morphinan-6-one

: 528854-53-7
4,5α-epoxy-3-methoxy-17-methyl-14β-(3-phenylpropyloxy)morphinan-6-one

Guidance literature:: With hydrogen; palladium on activated charcoal; In acetic acid; at 20 ℃; for 1h; under 2068.59 Torr;
DOI:10.1021/jm031126k