Acetophenone, 2-dimethylamino-3',4'-dihydroxy-, hydrochloride

Base Information

• Chemical Name: Acetophenone, 2-dimethylamino-3',4'-dihydroxy-, hydrochloride
• CAS No.: 16899-83-5
• Molecular Formula: C10H13 N O3 . Cl H
• Molecular Weight: 231.679
• Hs Code.: 29225000
• Mol file: 16899-83-5.mol

Synonyms:U 24274A;NSC 62512;SKI 28467;Acetophenone, 2-(dimethylamino)-3',4'-dihydroxy-, hydrochloride;Acetophenone, 2-dimethylamino-3',4'-dihydroxy-, hydrochloride;Ethanone, 1-(3,4-dihydroxyphenyl)-2-(dimethylamino)-, hydrochloride;ACETOPHENONE, 3',4'-DIHYDROXY-2-(DIMETHYLAMINO)-, HYDROCHLORIDE

Chemical Property of Acetophenone, 2-dimethylamino-3',4'-dihydroxy-, hydrochloride

Chemical Property:

• Melting Point: 236-237 °C
• Boiling Point: 387.9°Cat760mmHg
• Flash Point: 188.4°C
• PSA: 60.77000
• Density: g/cm³
• LogP: 1.64410
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 231.0662210
• Heavy Atom Count: 15
• Complexity: 206

Purity/Quality:

98%min ^*data from raw suppliers

N-MethyladrenaloneHydrochloride ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C[NH+](C)CC(=O)C1=CC(=C(C=C1)O)O.[Cl-]

Technology Process of Acetophenone, 2-dimethylamino-3',4'-dihydroxy-, hydrochloride

There total 1 articles about Acetophenone, 2-dimethylamino-3',4'-dihydroxy-, hydrochloride 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-chloro-3',4'-dihydroxyacetophenone (99-40-1) + dimethyl amine (124-40-3) → α-(dimethylamino)-3',4'-dihydroxyacetophenone hydrochloride (16899-83-5)

Guidance literature:

DOI:10.1021/jm00065a012

Reference yield:

α-(dimethylamino)-3',4'-dihydroxyacetophenone hydrochloride (16899-83-5) → N-Methylepinephrine (554-99-4)

Guidance literature:

With ethanol; platinum; Hydrogenation;

Reference yield:

α-(dimethylamino)-3',4'-dihydroxyacetophenone hydrochloride (16899-83-5) → (S)-1-(3,4-dihydroxy-phenyl)-2-dimethylamino-ethanol (554-99-4,6032-14-0,42173-39-7)

Guidance literature:

Multi-step reaction with 2 steps

1: platinum; ethanol / Hydrogenation

2: L_g-tartaric acid

With ethanol; L-Tartaric acid; platinum;

upstream raw materials:

2-chloro-3',4'-dihydroxyacetophenone

dimethyl amine

Downstream raw materials:

N-Methylepinephrine

(S)-1-(3,4-dihydroxy-phenyl)-2-dimethylamino-ethanol

(-)-isoproterenol

Refernces