9beta,11beta-Epoxy-6alpha-fluoro-17,21-dihydroxy-16alpha-methylpregna-1,4-diene-3,20-dione 21-acetate

Base Information

Chemical Name:9beta,11beta-Epoxy-6alpha-fluoro-17,21-dihydroxy-16alpha-methylpregna-1,4-diene-3,20-dione 21-acetate
CAS No.:4571-51-1
Molecular Formula:C24H29FO6
Molecular Weight:432.489
Hs Code.:
European Community (EC) Number:224-953-9
DSSTox Substance ID:DTXSID10963430
Nikkaji Number:J297.826A
Wikidata:Q76009930
Mol file:4571-51-1.mol

Synonyms:4571-51-1;EINECS 224-953-9;9beta,11beta-Epoxy-6alpha-fluoro-17,21-dihydroxy-16alpha-methylpregna-1,4-diene-3,20-dione 21-acetate;[2-[(1S,2S,8S,10S,11S,13R,14R,15S,17S)-8-Fluoro-14-hydroxy-2,13,15-trimethyl-5-oxo-18-oxapentacyclo[8.8.0.01,17.02,7.011,15]octadeca-3,6-dien-14-yl]-2-oxoethyl] acetate;SCHEMBL11443532;DTXSID10963430;AKOS030254948;6-Fluoro-17-hydroxy-16-methyl-3,20-dioxo-9,11-epoxypregna-1,4-dien-21-yl acetate;Acetic acid 9beta,11beta-epoxy-6alpha-fluoro-17-hydroxy-16alpha-methyl-3,20-dioxopregna-1,4-dien-21-yl ester

Suppliers and Price of 9beta,11beta-Epoxy-6alpha-fluoro-17,21-dihydroxy-16alpha-methylpregna-1,4-diene-3,20-dione 21-acetate

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Medical Isotopes, Inc.
(6α,9β,11β,16α)-21-(Acetyloxy)-9,11-epoxy-6-fluoro-17-hydroxy-16-methylpregna-1,4-diene-3,20-dione
10 mg
$ 625.00

Total 7 raw suppliers

Chemical Property of 9beta,11beta-Epoxy-6alpha-fluoro-17,21-dihydroxy-16alpha-methylpregna-1,4-diene-3,20-dione 21-acetate

Chemical Property:

Boiling Point:576.8°Cat760mmHg
Flash Point:302.6°C
PSA：93.20000
Density:1.33g/cm³
LogP:2.48290
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:432.19481680
Heavy Atom Count:31
Complexity:956

Purity/Quality:

99.9% ^*data from raw suppliers

(6α,9β,11β,16α)-21-(Acetyloxy)-9,11-epoxy-6-fluoro-17-hydroxy-16-methylpregna-1,4-diene-3,20-dione ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1CC2C3CC(C4=CC(=O)C=CC4(C35C(O5)CC2(C1(C(=O)COC(=O)C)O)C)C)F
Isomeric SMILES:C[C@@H]1C[C@H]2[C@@H]3C[C@@H](C4=CC(=O)C=C[C@@]4([C@]35[C@@H](O5)C[C@@]2([C@]1(C(=O)COC(=O)C)O)C)C)F

Technology Process of 9beta,11beta-Epoxy-6alpha-fluoro-17,21-dihydroxy-16alpha-methylpregna-1,4-diene-3,20-dione 21-acetate

There total 6 articles about 9beta,11beta-Epoxy-6alpha-fluoro-17,21-dihydroxy-16alpha-methylpregna-1,4-diene-3,20-dione 21-acetate 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:

: 9β,11β-epoxy-3-t-butyl-dimethylsilyloxy-17α,21-dihydroxy-16α-methylpregna-1,3,5-triene-20-one 21-acetate

: 4571-51-1
9β,11-epoxy-6α-fluoro-16α-methyl-17,21-dihydroxy-1,4-diene-3,20-dione 21-acetate

: 494870-04-1
6β-fluoro-9β,11β-epoxy-17α,21-dihydroxy-16α-methylpregna-1,4-diene-3,20-dione 21-acetate

Guidance literature:: 9β,11β-epoxy-3-t-butyl-dimethylsilyloxy-17α,21-dihydroxy-16α-methylpregna-1,3,5-triene-20-one 21-acetate; With 1H-imidazole; N-fluorobis(benzenesulfon)imide; In dichloromethane; at 15 - 20 ℃; for 2h;

With water; In dichloromethane; for 0.25h;

Reference yield:

: 2884-51-7
17α,21-dihydroxy-9β,11β-epoxy-16α-methylpregna-1,4-diene-3,20-dione 21-acetate

: 4571-51-1
9β,11-epoxy-6α-fluoro-16α-methyl-17,21-dihydroxy-1,4-diene-3,20-dione 21-acetate

Guidance literature:: 17α,21-dihydroxy-9β,11β-epoxy-16α-methylpregna-1,4-diene-3,20-dione 21-acetate; With Isopropenyl acetate; sulfuric acid; for 0.5h;

With Selectfluor; In acetonitrile;