1-(2-(3,4-Dimethoxyphenyl)ethyl)-4-propionylhydroxypiperidine hydrochloride

Base Information

• Chemical Name: 1-(2-(3,4-Dimethoxyphenyl)ethyl)-4-propionylhydroxypiperidine hydrochloride
• CAS No.: 134826-27-0
• Molecular Formula: C₁₈H₂₇NO₄*ClH
• Molecular Weight: 357.878
• DSSTox Substance ID: DTXSID90158968
• Mol file: 134826-27-0.mol

Synonyms:134826-27-0;1-(2-(3,4-Dimethoxyphenyl)ethyl)-4-propionylhydroxypiperidine hydrochloride;1-(2-(3,4-Dimethoxyphenyl)ethyl)-4-piperidinol propanoate (ester) hydrochloride;4-Piperidinol, 1-(2-(3,4-dimethoxyphenyl)ethyl)-, propanoate (ester), hydrochloride;[1-[2-(3,4-dimethoxyphenyl)ethyl]piperidin-4-yl] propanoate;hydrochloride;1-(2-(3,4-Dimethoxyphenyl)ethyl)-4-piperidinol propanoate (ester) hydr ochloride;DTXSID90158968;ZBLMVVNFLCQLDH-UHFFFAOYSA-N;LS-116993

Chemical Property of 1-(2-(3,4-Dimethoxyphenyl)ethyl)-4-propionylhydroxypiperidine hydrochloride

Chemical Property:

• Vapor Pressure: 5.51E-07mmHg at 25°C
• Boiling Point: 411.6°C at 760 mmHg
• Flash Point: 202.7°C
• PSA: 48.00000
• LogP: 3.40380
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 8
• Exact Mass: 357.1706861
• Heavy Atom Count: 24
• Complexity: 355

Purity/Quality:

1-(2-(3,4-DIMETHOXYPHENYL)ETHYL)-4-PIPERIDINOL PROPANOATE (ESTER) HYDR OCHLORIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCC(=O)OC1CCN(CC1)CCC2=CC(=C(C=C2)OC)OC.Cl

Technology Process of 1-(2-(3,4-Dimethoxyphenyl)ethyl)-4-propionylhydroxypiperidine hydrochloride

There total 2 articles about 1-(2-(3,4-Dimethoxyphenyl)ethyl)-4-propionylhydroxypiperidine 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: 95.5%

propionyl chloride (79-03-8) + 1-<2-(3,4-dimethoxyphenyl)ethyl>-4-hydroxypiperidine (134826-25-8) → 1-<2-(3,4-dimethoxyphenyl)ethyl>-4-propionylhydroxypiperidine hydrochloride (134826-27-0)

Guidance literature:

With propionic acid anhydride; for 24h; Ambient temperature;

DOI:10.1007/BF00772104

Reference yield:

1-<2-(3,4-dimethoxyphenyl)ethyl>-4-piperidone (3612-14-4) → 1-<2-(3,4-dimethoxyphenyl)ethyl>-4-propionylhydroxypiperidine hydrochloride (134826-27-0)

Guidance literature:

Multi-step reaction with 2 steps

1: 99.9 percent / NaBH₄ / propan-2-ol / 1.) RT, 1 h, 2.) from 50 to 55 deg C, 1 h

2: 95.5 percent / propionic anhydride / 24 h / Ambient temperature

With sodium tetrahydroborate; propionic acid anhydride; In isopropyl alcohol;

DOI:10.1007/BF00772104

upstream raw materials:

propionyl chloride

1-<2-(3,4-dimethoxyphenyl)ethyl>-4-hydroxypiperidine

1-<2-(3,4-dimethoxyphenyl)ethyl>-4-piperidone

Refernces