Oxidopamine

Base Information

• Chemical Name: Oxidopamine
• CAS No.: 1199-18-4
• Molecular Formula: C8H11 N O3
• Molecular Weight: 169.18
• Hs Code.: 2922299090
• European Community (EC) Number: 214-842-3
• UN Number: 2811
• UNII: 8HW4YBZ748
• DSSTox Substance ID: DTXSID0036768
• Nikkaji Number: J126K
• Wikipedia: Oxidopamine
• Wikidata: Q780181
• NCI Thesaurus Code: C1316
• Pharos Ligand ID: MZUGRB3FR6NK
• Metabolomics Workbench ID: 37855
• ChEMBL ID: CHEMBL337702
• Mol file: 1199-18-4.mol

Synonyms:6 Hydroxydopamine;6-Hydroxydopamine;6-OHDA;Hydrobromide, Oxidopamine;Hydrochloride, Oxidopamine;Oxidopamine;Oxidopamine Hydrobromide;Oxidopamine Hydrochloride

Chemical Property of Oxidopamine

Chemical Property:

• Vapor Pressure: 3.58E-07mmHg at 25°C
• Refractive Index: 1.5100 (estimate)
• Boiling Point: 406°Cat760mmHg
• Flash Point: 199.3°C
• PSA: 86.71000
• Density: 1.395g/cm³
• LogP: 1.00490
• XLogP3: 0.2
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 169.07389321
• Heavy Atom Count: 12
• Complexity: 142
• Transport DOT Label: Poison

Purity/Quality:

98%,99%, ^*data from raw suppliers

OXIDOPAMINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C(=CC(=C1O)O)O)CCN
• Uses: Adrenergic (ophthalmic).

Technology Process of Oxidopamine

There total 25 articles about Oxidopamine 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:

2-(2,4,5-Tris-benzyloxy-phenyl)-ethylamine; hydrochloride → 6-Hydroxydopamin (1199-18-4)

Guidance literature:

With hydrogen; palladium on activated charcoal; In ethanol;

DOI:10.1021/jm00285a034

Reference yield:

asaraldehyde (4460-86-0,14374-62-0) → 6-Hydroxydopamin (1199-18-4)

Guidance literature:

Multi-step reaction with 3 steps

2: H₂, aq. HCl / Pd-C / ethanol

3: HBr, AcOH

With hydrogenchloride; hydrogen bromide; hydrogen; acetic acid; palladium on activated charcoal; In ethanol;

DOI:10.1016/0040-4020(73)80127-9

Reference yield:

2,4,5-trimethoxybenzeneacetonitrile (38444-50-7) → 6-Hydroxydopamin (1199-18-4)

Guidance literature:

Multi-step reaction with 2 steps

1: H₂, aq. HCl / Pd-C / ethanol

2: HBr, AcOH

With hydrogenchloride; hydrogen bromide; hydrogen; acetic acid; palladium on activated charcoal; In ethanol;

DOI:10.1016/0040-4020(73)80127-9

upstream raw materials:

1-(2,4,5-trimethoxyphenyl)-2-aminoethane

2-(2-amino-ethyl)-5-methoxy-hydroquinone

2,4,5-trihydroxyphenyl-L-alanine

4-(N,N-dimethylamino)phenol

Downstream raw materials:

4-(N,N-dimethylamino)phenol

2,2,2-Trifluoro-N-{2-[2,4,5-tris-(dimethyl-propyl-silanyloxy)-phenyl]-ethyl}-acetamide

2-hydroxy-5-(2-aminoethyl)-1,4-benzoquinone

4-(2-Amino-ethyl)-5-hydroxy-[1,2]benzoquinone

Refernces

• 1、 Napolitano, Alessandra,Pezzella, Alessandro,Prota, Giuseppe. "6,7-Dihydroxy-1,2,3,4-tetrahydroisoquinoline formation by iron mediated dopamine oxidation: A novel route to endogenous neurotoxins under oxidative stress conditions". . p. 2833 - 2836. Retrieved 1999.
• 2、 Steenken, S.,Neta, P.. "One-Electron Redox Potentials of Phenols. Hydroxy- and Aminophenols and Related Compounds of Biological Interest". . p. 3661 - 3667. Retrieved 2007/10/02.