N,N-Dimethylcathinone

Base Information

• Chemical Name: N,N-Dimethylcathinone
• CAS No.: 35026-77-8
• Molecular Formula: C11H15NO
• Molecular Weight: 177.246
• UNII: Y1C71G22Y1
• DSSTox Substance ID: DTXSID701344549
• Nikkaji Number: J60.606E
• Wikidata: Q27294137
• Mol file: 35026-77-8.mol

Synonyms:N,N-dimethylcathinone

Chemical Property of N,N-Dimethylcathinone

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 177.115364102
• Heavy Atom Count: 13
• Complexity: 171

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C(=O)C1=CC=CC=C1)N(C)C
• Isomeric SMILES: C[C@@H](C(=O)C1=CC=CC=C1)N(C)C

Technology Process of N,N-Dimethylcathinone

There total 6 articles about N,N-Dimethylcathinone 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:

metamfepramone (15351-09-4) → (S)-2-(dimethylamino)propiophenone (35026-77-8)

Guidance literature:

Reference yield:

1-phenyl-propan-1-one (93-55-0) → (S)-2-(dimethylamino)propiophenone (35026-77-8)

Guidance literature:

Multi-step reaction with 4 steps

1: acetic acid; bromine / 22 h / 20 °C

2: triethylamine / dichloromethane / 21 h / 20 °C

3: sodium hydroxide / acetone; water / 20 °C

4: sodium hydroxide / water

With bromine; acetic acid; triethylamine; sodium hydroxide; In dichloromethane; water; acetone;

DOI:10.1039/c5ob01306b

Reference yield:

2-bromo-1-phenyl-1-propanone (2114-00-3) → (S)-2-(dimethylamino)propiophenone (35026-77-8)

Guidance literature:

Multi-step reaction with 3 steps

1: triethylamine / dichloromethane / 21 h / 20 °C

2: sodium hydroxide / acetone; water / 20 °C

3: sodium hydroxide / water

With triethylamine; sodium hydroxide; In dichloromethane; water; acetone;

DOI:10.1039/c5ob01306b

upstream raw materials:

metamfepramone

(S)-2-dimethylamino-1-phenyl-propan-1-one; O,O'-dibenzoyl-L_g-hydrogentartrate

2-bromo-1-phenyl-1-propanone

1-phenyl-propan-1-one

Downstream raw materials:

(S)-N,N-dimethyl-α-benzylethylamine

(-)-N-methylephedrine

(1S,2S)-N-Methylpseudoephedrine

(+)(2Ξ,3S)-3-dimethylamino-2-phenyl-butan-2-ol

Refernces