Acetyldihydrocodeinone

Base Information Edit

Chemical Name:Acetyldihydrocodeinone
CAS No.:466-90-0
Molecular Formula:C20H23 N O4
Molecular Weight:341.407
Hs Code.:
European Community (EC) Number:207-377-2
UNII:520D430GDK
ChEMBL ID:CHEMBL2104751
DSSTox Substance ID:DTXSID90891944
Metabolomics Workbench ID:154264
NCI Thesaurus Code:C91052
Nikkaji Number:J5.903J
Wikidata:Q2787672
Wikipedia:Thebacon
Mol file:466-90-0.mol

Synonyms:Thebacon;Acetyldihydrocodeinone;Dihydrocodeinone enol acetate;Acetyldemethyldihydrothebaine;DEA No. 9315;466-90-0;Acedikon;IDS-NT-001;520D430GDK;Thebacon (INN);Acetyldihydrokodeinon;NSC-117860;THEBACON [INN];Thebaconum;Tebacona;Tebacone;Thebaine, demethyldihydro-, acetate;NSC 117860;Acedikon [Czech];Tebacone [DCIT];Tebacona [INN-Spanish];Thebacone [INN-French];Thebaconum [INN-Latin];Thebacon [INN:BAN:DCF];Thebacetyl;Acetyldihydrokodeinon [Czech];UNII-520D430GDK;EINECS 207-377-2;BRN 0056871;THEBACON [MI];THEBACON [WHO-DD];SCHEMBL25766;4-27-00-02218 (Beilstein Handbook Reference);CHEMBL2104751;DTXSID90891944;CHEBI:135449;Morphinan-6-ol, 6,7-didehydro-4,5-epoxy-3-methoxy-17-methyl-, 6-acetate, (5.alpha.)-;DB13458;D07386;Q2787672;MORPHINAN-6-OL, 6,7-DIDEHYDRO-4,5-alpha-EPOXY-3-METHOXY-17-METHYL-, ACETATE;Morphinan-6-ol, 6,7-didehydro-4,5-epoxy-3-methoxy-17-methyl-, acetate (ester), (5alpha)-;Morphinan-6-ol, 6,7-didehydro-4,5alpha-epoxy-3-methoxy-17-methyl-, acetate (ester)

This product is a nationally controlled contraband, and the Lookchem platform doesn't provide relevant sales information.

Chemical Property of Acetyldihydrocodeinone Edit

Chemical Property:

Vapor Pressure:0mmHg at 25°C
Melting Point:154°
Boiling Point:486.1°Cat760mmHg
PKA:8.03±0.40(Predicted)
Flash Point:247.8°C
PSA：48.00000
Density:1.31g/cm³
LogP:2.35900
XLogP3:2.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:341.16270821
Heavy Atom Count:25
Complexity:619

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)OC1=CCC2C3CC4=C5C2(C1OC5=C(C=C4)OC)CCN3C
Isomeric SMILES:CC(=O)OC1=CC[C@H]2[C@H]3CC4=C5[C@]2([C@H]1OC5=C(C=C4)OC)CCN3C
Therapeutic Function Narcotic analgesic, Antitussive

Technology Process of Acetyldihydrocodeinone

There total 2 articles about Acetyldihydrocodeinone 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:

: 108-24-7
acetic anhydride

: 466-90-0
6-OAc hydrocodone

Guidance literature:: dihydrocodeine; With benzophenone; potassium tert-butylate; In cyclohexane; at 30 - 40 ℃; for 4h;

acetic anhydride; In cyclohexane; at 20 ℃; for 0.5h;

With ammonia; acetic acid; more than 3 stages;