R,R-Fenoterol

Base Information

• Chemical Name: R,R-Fenoterol
• CAS No.: 130156-24-0
• Deprecated CAS: 1334420-40-4
• Molecular Formula: C₁₇H₂₁NO₄
• Molecular Weight: 303.358
• UNII: 22M9P70OQ9,5Z64M7W0JM
• Nikkaji Number: J3.221.024D
• NCI Thesaurus Code: C65659
• Pharos Ligand ID: MRRJN7LCCLK7
• ChEMBL ID: CHEMBL388570
• Mol file: 130156-24-0.mol

Synonyms:Berotec;Berotek;Fenoterol;Fenoterol Hydrobromide;Fenoterol Hydrochloride;Hydrochloride, Fenoterol;p Hydroxyphenyl orciprenaline;p Hydroxyphenylorciprenaline;p-Hydroxyphenyl-orciprenaline;p-Hydroxyphenylorciprenaline;Partusisten;Phenoterol;Th 1165a;Th-1165a;Th1165a

Chemical Property of R,R-Fenoterol

Chemical Property:

• PSA: 92.95000
• LogP: 2.44850
• XLogP3: 2
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 303.14705815
• Heavy Atom Count: 22
• Complexity: 310

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(CC1=CC=C(C=C1)O)NCC(C2=CC(=CC(=C2)O)O)O
• Isomeric SMILES: C[C@H](CC1=CC=C(C=C1)O)NC[C@@H](C2=CC(=CC(=C2)O)O)O

Technology Process of R,R-Fenoterol

There total 46 articles about R,R-Fenoterol 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:

→ fenoterol (13392-18-2,130156-24-0,391234-95-0)

Guidance literature:

entspr. 3.5-Dibenzyloxyverb.*HCl (einzelnes Diastereomer, F:176grad), H2, Pd/C;

Reference yield:

C45H45NO4 (1026184-18-8) → (R,R)-(-)-Fenoterol (130156-24-0,391234-95-0)

Guidance literature:

With hydrogen; palladium on activated charcoal; In ethanol; for 24h; under 2585.81 Torr;

DOI:10.1021/jm070030d

Reference yield:

C45H45NO4 (1026431-76-4) → (S,R)-5-(1-hydroxy-2-{[2-(4-hydroxyphenyl)-1-methylethyl]amino}ethyl)benzene-1,3-diol (130156-24-0,391234-95-0)

Guidance literature:

With hydrogen; palladium on activated charcoal; In ethanol; for 24h; under 2585.81 Torr;

DOI:10.1021/jm070030d

upstream raw materials:

rac-(2R)-N-[(2R)-2-(3,5-dihydroxyphenyl)-2-hydroxyethyl]-1-(4-hydroxyphenyl)propan-2-ammonium bromide

2-bromo-1-(3,5-bis(benzyloxy)phenyl)ethanol

1-(4-benzyloxyphenyl)-2-benzylaminopropane

(S)-(+)-1-(4-benzyloxyphenyl)-2-benzylaminopropane

Refernces

• 1、 -. "Use of fenoterol and fenoterol analogues in the treatment of glioblastomas and astrocytomas". Page/Page column 40-41. . Retrieved 2016/12/07.
• 2、 Jozwiak, Krzysztof,Khalid, Chakir,Tanga, Mary J.,Berzetei-Gurske, Ilona,Jimenez, Lucita,Kozocas, Joseph A.,Woo, Anthony,Zhu, Weizhong,Xiao, Rui-Ping,Abernethy, Darrell R.,Wainer, Irving W.. "Comparative molecular field analysis of the binding of the stereoisomers of fenoterol and fenoterol derivatives to the β2 adrenergic receptor". . p. 2903 - 2915. Retrieved 2008/02/07.