Xamoterol fumarate

Base Information

Chemical Name:Xamoterol fumarate
CAS No.:90730-93-1
Molecular Formula:C₄H₄O₄*C₁₆H₂₅N₃O₅
Molecular Weight:455.465
Hs Code.:
European Community (EC) Number:277-319-9
UNII:N87007N668
DSSTox Substance ID:DTXSID501349036
Wikidata:Q27284698
NCI Thesaurus Code:C152925
ChEMBL ID:CHEMBL1329567

Synonyms:Carwin;Corwin;Fumarate, Xamoterol;Hemifumarate, Xamoterol;ICI 118587;ICI-118587;ICI118587;Monohydrobromide, Xamoterol;Monohydrochloride, Xamoterol;Xamoterol;Xamoterol Fumarate;Xamoterol Hemifumarate;Xamoterol Maleate (2:1);Xamoterol Monohydrobromide;Xamoterol Monohydrochloride;Xamoterol, (S)-Isomer;Xamtol

Suppliers and Price of Xamoterol fumarate

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

Total 0 raw suppliers

Chemical Property of Xamoterol fumarate

Chemical Property:

Hydrogen Bond Donor Count:10
Hydrogen Bond Acceptor Count:16
Rotatable Bond Count:18
Exact Mass:794.36980042
Heavy Atom Count:56
Complexity:477

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1COCCN1C(=O)NCCNCC(COC2=CC=C(C=C2)O)O.C1COCCN1C(=O)NCCNCC(COC2=CC=C(C=C2)O)O.C(=CC(=O)O)C(=O)O
Isomeric SMILES:C1COCCN1C(=O)NCCNCC(COC2=CC=C(C=C2)O)O.C1COCCN1C(=O)NCCNCC(COC2=CC=C(C=C2)O)O.C(=C/C(=O)O)\C(=O)O

Technology Process of Xamoterol fumarate

There total 12 articles about Xamoterol fumarate 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: 91.7%

: 122715-70-2,69630-21-3
(S)-N-(2-(3-(4-(benzyloxy)phenoxy)-2-hydroxypropylamino)ethyl)morpholine-4-carboxamide

: 110-17-8,26099-09-2
(2E)-but-2-enedioic acid

: 73210-73-8,90730-93-1
(S)-xamoterol hemifumarate

Guidance literature:: (S)-N-(2-(3-(4-(benzyloxy)phenoxy)-2-hydroxypropylamino)ethyl)morpholine-4-carboxamide; With hydrogen; acetic acid; In ethanol; under 2844.39 Torr;

(2E)-but-2-enedioic acid; In ethanol;
DOI:10.1371/journal.pone.0180319

Reference yield:

: 69630-21-3
(R)-N-(2-(3-(4-(benzyloxy)phenoxy)-2-hydroxypropylamino)ethyl)morpholine-4-carboxamide

: 110-17-8,26099-09-2
(2E)-but-2-enedioic acid

: 73210-73-8,90730-93-1
(R)-xamoterol hemifumarate

Guidance literature:: (R)-N-(2-(3-(4-(benzyloxy)phenoxy)-2-hydroxypropylamino)ethyl)morpholine-4-carboxamide; With hydrogen; acetic acid; In ethanol; under 2844.39 Torr;

(2E)-but-2-enedioic acid; In ethanol;
DOI:10.1371/journal.pone.0180319

Reference yield:

: 1-p-benzyloxyphenoxy-3-(beta-morpholinocarbonamidoethyl)amino-2-propanol hydrochloride

: 110-17-8,26099-09-2
(2E)-but-2-enedioic acid

: 73210-73-8,90730-93-1
1-p-hydroxyphenoxy-3-beta-(morpholinocarbonamido)ethyl-amino-2-propanol fumerate

Guidance literature:: 1-p-benzyloxyphenoxy-3-(beta-morpholinocarbonamidoethyl)amino-2-propanol hydrochloride; With palladium on activated charcoal; hydrogen; acetic acid; In ethanol;

(2E)-but-2-enedioic acid; In ethanol; at 5 ℃; for 12h;