6beta-Hydroxy-ethinylestradiol

Base Information

Chemical Name:6beta-Hydroxy-ethinylestradiol
CAS No.:56324-28-8
Molecular Formula:C₂₀H₂₄O₃
Molecular Weight:312.409
Hs Code.:
European Community (EC) Number:641-772-4
UNII:G1W6D0O0CW
ChEMBL ID:CHEMBL1627665
DSSTox Substance ID:DTXSID80204867
Nikkaji Number:J1.691.118F
Wikidata:Q27278624
Mol file:56324-28-8.mol

Synonyms:56324-28-8;6beta-Hydroxy-ethinylestradiol;6beta-Hydroxy Ethynyl Estradiol;6ss-Hydroxy-ethynylestradiol;G1W6D0O0CW;(6R,8R,9S,13S,14S,17R)-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,6,17-triol;(6R,8R,9S,13S,14S,17R)-17-Ethynyl-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthrene-3,6,17-triol;19-Nor-17alpha-pregna-1,3,5(10)-trien-20-yne-3,6beta,17-triol (6beta-Hydroxyethinylestradiol);UNII-G1W6D0O0CW;6beta-Hydroxy-ethinyl estradiol;Ethinylestradiol impurity F [EP];Ethinylestradiol specified impurity F [EP];Ethynyl Estradiol Impurity;SCHEMBL3947959;CHEMBL1627665;DTXSID80204867;6 beta -Hydroxy Ethynyl Estradiol;19-Nor-17alpha-pregna-1,3,5(10)-trien-20-yne-3,6beta,17-triol;19-Norpregna-1,3,5(10)-trien-20-yne-3,6,17-triol, (6beta,17alpha)-;AKOS032958170;6.BETA.-HYDROXY-ETHINYLESTRADIOL;6.BETA.-HYDROXY-ETHINYL ESTRADIOL;F96981;ETHINYLESTRADIOL IMPURITY F [EP IMPURITY];Q27278624;1,3,5(10)-Estratrien-17-alpha-ethynyl-3,6-alpha,17-beta-triol;19-NOR-17.ALPHA.-PREGNA-1,3,5(10)-TRIEN-20-YNE-3,6.BETA.,17-TRIOL;19-NORPREGNA-1,3,5(10)-TRIEN-20-YNE-3,6,17-TRIOL, (6.BETA.,17.ALPHA.)-;Ethinylestradiol Imp. F (EP);6beta-Hydroxyethinylestradiol;Ethinylestradiol Impurity F

Suppliers and Price of 6beta-Hydroxy-ethinylestradiol

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

TRC
6β-HydroxyEthynylEstradiol
5mg
$ 295.00

American Custom Chemicals Corporation
(6BETA,17A)-19-NORPREGNA-1,3,5(10)-TRIEN-20-YNE-3,6,17-TRIOL 95.00%
100MG
$ 1963.50

American Custom Chemicals Corporation
(6BETA,17A)-19-NORPREGNA-1,3,5(10)-TRIEN-20-YNE-3,6,17-TRIOL 95.00%
10MG
$ 750.75

AK Scientific
6beta-Hydroxy-ethinylestradiol
500mg
$ 7781.00

Total 7 raw suppliers

Chemical Property of 6beta-Hydroxy-ethinylestradiol

Chemical Property:

PSA：60.69000
LogP:3.10350
XLogP3:2.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:312.17254462
Heavy Atom Count:23
Complexity:536

Purity/Quality:

> 95% ^*data from raw suppliers

6β-HydroxyEthynylEstradiol ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC12CCC3C(C1CCC2(C#C)O)CC(C4=C3C=CC(=C4)O)O
Isomeric SMILES:C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)C[C@H](C4=C3C=CC(=C4)O)O
Uses Ethynyl Estradiol (E685100) impurity F.

Technology Process of 6beta-Hydroxy-ethinylestradiol

There total 6 articles about 6beta-Hydroxy-ethinylestradiol 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: 64.0%