Methoxyphedrine

Base Information

• Chemical Name: Methoxyphedrine
• CAS No.: 530-54-1
• Molecular Formula: C11H15NO2
• Molecular Weight: 193.246
• Hs Code.: 2922509090
• European Community (EC) Number: 684-468-7
• UNII: L7HY239I58
• DSSTox Substance ID: DTXSID20862127
• Nikkaji Number: J6.703B
• Wikipedia: Methedrone
• Wikidata: Q2506962
• NCI Thesaurus Code: C90631
• ChEMBL ID: CHEMBL2106893
• Mol file: 530-54-1.mol

Synonyms:4-methoxymethcathinone;methedrone

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Chemical Property of Methoxyphedrine

Chemical Property:

• Vapor Pressure: 0.000487mmHg at 25°C
• Refractive Index: 1.507
• Boiling Point: 313.7 °C at 760 mmHg
• PKA: 7.48±0.10(Predicted)
• Flash Point: 143.5 °C
• PSA: 38.33000
• Density: 1.032 g/cm³
• LogP: 1.87670
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 193.110278721
• Heavy Atom Count: 14
• Complexity: 186

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC(C(=O)C1=CC=C(C=C1)OC)NC

Technology Process of Methoxyphedrine

There total 5 articles about Methoxyphedrine 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:

4-Methoxypropiophenone (121-97-1) → 4‐methoxymethcathinone (530-54-1)

Guidance literature:

Multi-step reaction with 2 steps

1: bromine / dichloromethane

2: dichloromethane / 12 h

With bromine; In dichloromethane;

DOI:10.3390/ijms20071524

Reference yield:

methoxybenzene (100-66-3) → 4‐methoxymethcathinone (530-54-1)

Guidance literature:

Multi-step reaction with 3 steps

1: aluminum (III) chloride / dichloromethane

2: bromine / dichloromethane

3: dichloromethane / 12 h

With aluminum (III) chloride; bromine; In dichloromethane; 1: |Friedel-Crafts Acylation;

DOI:10.3390/ijms20071524

Reference yield:

methylamine (74-89-5) → 4‐methoxymethcathinone (530-54-1)

Guidance literature:

With benzene;

upstream raw materials:

methylamine

2-bromo-1-(4-methoxyphenyl)-1-propanone

4-Methoxypropiophenone

methoxybenzene

Downstream raw materials:

(+/-)-erythro-2-methylamino-1-(4-methoxy-phenyl)-propanol-⁽¹⁾

Refernces