Icometasone

Base Information Edit

Chemical Name:Icometasone
CAS No.:4647-20-5
Molecular Formula:C₂₂H₂₉ClO₅
Molecular Weight:408.922
Hs Code.:
UNII:2LP8SJ795G
DSSTox Substance ID:DTXSID40196850
Nikkaji Number:J536.078A
Wikipedia:Icometasone
Mol file:4647-20-5.mol

Synonyms:Icomethasone;Icometasone;4647-20-5;(8S,9R,10S,11S,13S,14S,16R,17R)-9-chloro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one;2LP8SJ795G;UNII-2LP8SJ795G;SCHEMBL7755941;DTXSID40196850;AKOS040768320;Pregna-1,4-diene-3,20-dione, 9-chloro-11,17,21-trihydroxy-16-methyl-, (11beta,16alpha)-;PD162044;MOMETASONE FUROATE IMPURITY K [EP IMPURITY];Q27254899;9-Chloro-11beta,17,21-trihydroxy-16alpha-methylpregna-1,4-diene-3,20-dione (Icometasone);(11.BETA.,16.ALPHA.)-9-CHLORO-11,17,21-TRIHYDROXY-16-METHYLPREGNA-1,4-DIENE-3,20-DIONE;PREGNA-1,4-DIENE-3,20-DIONE, 9-CHLORO-11,17,21-TRIHYDROXY-16-METHYL-, (11.BETA.,16.ALPHA.)-

Suppliers and Price of Icometasone

Supply Marketing:Edit

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
Icomethasone
10mg
$ 100.00

Medical Isotopes, Inc.
Icomethasone
100 mg
$ 2200.00

Total 5 raw suppliers

Chemical Property of Icometasone Edit

Chemical Property:

Melting Point:229-234 °C
Boiling Point:600.2±55.0 °C(Predicted)
PKA:12.17±0.70(Predicted)
PSA：94.83000
Density:1.35±0.1 g/cm3(Predicted)
LogP:2.16500
Storage Temp.:-20°C Freezer
Solubility.:DMSO (Slightly), Methanol (Slightly)
XLogP3:2.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:408.1703517
Heavy Atom Count:28
Complexity:805

Purity/Quality:

98%Min ^*data from raw suppliers

Icomethasone ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1CC2C3CCC4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)CO)O)C)O)Cl)C
Isomeric SMILES:C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)CO)O)C)O)Cl)C
Uses Icomethasone is a metabolite of Mometasone Furoate (M490000).

Technology Process of Icometasone

There total 3 articles about Icometasone 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: 97.0%

: 981-34-0
9β,11β-epoxy-17α,21-dihydroxy-16β-methylpregna-1,4-diene-3,20-dione

: 4419-39-0,4647-20-5
beclomethasone

Guidance literature:: With hydrogenchloride; In dichloromethane; water; at 0 - 25 ℃; for 1.5h; Temperature; Solvent;
DOI:10.1016/j.steroids.2021.108948