Unii-tsb3CJ6F7M

Base Information

Chemical Name:Unii-tsb3CJ6F7M
CAS No.:14622-47-0
Molecular Formula:C₂₂H₂₈O₅
Molecular Weight:372.461
Hs Code.:
UNII:TSB3CJ6F7M
Mol file:14622-47-0.mol

Synonyms:UNII-TSB3CJ6F7M;TSB3CJ6F7M;Dexamethasone impurity I [EP];(1R,2S,10S,11S,13R,14R,15S,17R)-14-Hydroxy-14-(2-hydroxyacetyl)-2,13,15-trimethyl-18-oxapentacyclo[8.8.0.01,17.02,7.011,15]octadeca-3,6-dien-5-one;14622-47-0;(11alpha,16alpha)-9,11-Epoxy-17,21-dihydroxy-16-methylpregna-1,4-diene-3,20-dione;9alpha,11alpha-Epoxy-17,21-dihydroxy-16alpha-methylpregna-1,4-diene-3,20-dione;Pregna-1,4-diene-3,20-dione, 9,11-epoxy-17,21-dihydroxy-16-methyl-, (11alpha,16alpha)-;AKOS032428548;CS-0166357;DEXAMETHASONE IMPURITY I [EP IMPURITY];(11.ALPHA.,16.ALPHA.)-9,11-EPOXY-17,21-DIHYDROXY-16-METHYLPREGNA-1,4-DIENE-3,20-DIONE;(4aS,4bR,5aR,6aS,7R,8R,9aS,9bS)-7-hydroxy-7-(2-hydroxyacetyl)-4a,6a,8-trimethyl-5a,6,6a,7,8,9,9a,9b,10,11-decahydrocyclopenta[1,2]phenanthro[4,4a-b]oxiren-2(4aH)-one? (Dexamethasone Impurity;9.ALPHA.,11.ALPHA.-EPOXY-17,21-DIHYDROXY-16.ALPHA.-METHYLPREGNA-1,4-DIENE-3,20-DIONE;PREGNA-1,4-DIENE-3,20-DIONE, 9,11-EPOXY-17,21-DIHYDROXY-16-METHYL-, (11.ALPHA.,16.ALPHA.)-

Suppliers and Price of Unii-tsb3CJ6F7M

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
(11α,16α)-9,11-Epoxy-17,21-dihydroxy-16-methylpregna-1,4-diene-3,20-dione
25mg
$ 1695.00

Total 15 raw suppliers

Chemical Property of Unii-tsb3CJ6F7M

Chemical Property:

Boiling Point:564.9±50.0 °C(Predicted)
PKA:12.56±0.70(Predicted)
PSA：87.13000
Density:1.32±0.1 g/cm3(Predicted)
LogP:1.96410
Storage Temp.:Refrigerator
Solubility.:DMSO (Slightly), Methanol (Slightly, Sonicated)
XLogP3:2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:372.19367399
Heavy Atom Count:27
Complexity:814

Purity/Quality:

99% ^*data from raw suppliers

(11α,16α)-9,11-Epoxy-17,21-dihydroxy-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:CC1CC2C3CCC4=CC(=O)C=CC4(C35C(O5)CC2(C1(C(=O)CO)O)C)C
Isomeric SMILES:C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@@]35[C@H](O5)C[C@@]2([C@]1(C(=O)CO)O)C)C
Uses (11α,16α)-9,11-Epoxy-17,21-dihydroxy-16-methylpregna-1,4-diene-3,20-dione, can be used for the synthesis of Calicoferol E, a vitamin D3 analogues.

Technology Process of Unii-tsb3CJ6F7M

There total 3 articles about Unii-tsb3CJ6F7M 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: