3-Methoxy-4-[2-(piperidin-1-yl)ethoxy]benzaldehyde

Base Information

• Chemical Name: 3-Methoxy-4-[2-(piperidin-1-yl)ethoxy]benzaldehyde
• CAS No.: 46995-88-4
• Molecular Formula: C15H21NO3
• Molecular Weight: 263.337
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID30389830
• Wikidata: Q82186021
• Mol file: 46995-88-4.mol

Synonyms:46995-88-4;3-methoxy-4-[2-(piperidin-1-yl)ethoxy]benzaldehyde;3-methoxy-4-(2-piperidin-1-ylethoxy)benzaldehyde;3-Methoxy-4-(2-piperidin-1-yl-ethoxy)-benzaldehyde;3-METHOXY-4-[2-(1-PIPERIDINYL)ETHOXY]BENZALDEHYDE;3-Methoxy-4-(2-(piperidin-1-yl)ethoxy)benzaldehyde;3-Methoxy-4-(2-piperidin-1-yl-ethoxy)benzaldehyde;SCHEMBL2421772;DTXSID30389830;BBL038192;MFCD02254124;STK347842;AKOS000295491;BB 0217789;CS-0116587;FT-0723298;EN300-227929;Z352250684

Chemical Property of 3-Methoxy-4-[2-(piperidin-1-yl)ethoxy]benzaldehyde

Chemical Property:

• Vapor Pressure: 5.34E-07mmHg at 25°C
• Boiling Point: 412°C at 760 mmHg
• Flash Point: 203°C
• PSA: 38.77000
• Density: 1.101g/cm³
• LogP: 2.31030
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 263.15214353
• Heavy Atom Count: 19
• Complexity: 266

Purity/Quality:

97% ^*data from raw suppliers

3-Methoxy-4-(2-piperidin-1-yl-ethoxy)-benzaldehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=CC(=C1)C=O)OCCN2CCCCC2

Technology Process of 3-Methoxy-4-[2-(piperidin-1-yl)ethoxy]benzaldehyde

There total 5 articles about 3-Methoxy-4-[2-(piperidin-1-yl)ethoxy]benzaldehyde 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: 83.0%

piperidine (110-89-4) + 4-(2-bromo-ethoxy)-3-methoxy-benzaldehyde (99070-23-2) → 3-methoxy-4-[2-(piperidine-1-yl)ethoxy]-benzaldehyde (46995-88-4)

Guidance literature:

In methanol; water; at 20 ℃; for 60h;

DOI:10.1002/jhet.47

Reference yield:

N-chloroethylpiperidine hydrochloride (2008-75-5) + vanillin (121-33-5,8014-42-4) → 3-methoxy-4-[2-(piperidine-1-yl)ethoxy]-benzaldehyde (46995-88-4)

Guidance literature:

With potassium carbonate; In butanone; for 6h; Reflux;

DOI:10.1016/j.steroids.2008.07.004 DOI:10.1016/j.ejmech.2008.10.017

Reference yield:

vanillin (121-33-5,8014-42-4) → 3-methoxy-4-[2-(piperidine-1-yl)ethoxy]-benzaldehyde (46995-88-4)

Guidance literature:

Multi-step reaction with 2 steps

1: K₂CO₃; acetone

2: potassium iodide; ethanol

With ethanol; potassium carbonate; acetone; potassium iodide;

DOI:10.1007/BF00906086

upstream raw materials:

piperidine

4-(2-bromo-ethoxy)-3-methoxy-benzaldehyde

1-(2-bromo-ethyl)-piperidine

vanillin

Downstream raw materials:

16-[3-methoxy-4-{2-(piperidin-1-yl)ethoxy}-benzylidene]-17-oxo-5-androsten-3β-ol

2-{4-[2-piperidinoethoxy]-3-methoxyphenyl}-4,5-diphenylimidazole

6-amino-5-[{3-methoxy-4-(2-piperidin-1-ylethoxy)benzylidene}amino]-1,3-dimethyluracil

3-methoxy-4-[2-(piperidin-1-yl)ethoxy]phenylmethanol