(E)-alpha-Ethylidenepiperidine-1-acetaldehyde

Base Information

• Chemical Name: (E)-alpha-Ethylidenepiperidine-1-acetaldehyde
• CAS No.: 52900-93-3
• Molecular Formula: C9H15 N O
• Molecular Weight: 153.224
• Hs Code.: 2933399090
• European Community (EC) Number: 258-249-8
• DSSTox Substance ID: DTXSID50967371
• Mol file: 52900-93-3.mol

Synonyms:52900-93-3;(E)-alpha-Ethylidenepiperidine-1-acetaldehyde;EINECS 258-249-8;2-Piperidino-2-butenal;SCHEMBL12408151;2-(piperidin-1-yl)but-2-enal;DTXSID50967371

Chemical Property of (E)-alpha-Ethylidenepiperidine-1-acetaldehyde

Chemical Property:

• Boiling Point: 277.4°Cat760mmHg
• Flash Point: 106.1°C
• PSA: 20.31000
• Density: 0.986g/cm³
• LogP: 1.51290
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 153.115364102
• Heavy Atom Count: 11
• Complexity: 157

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC=C(C=O)N1CCCCC1

Technology Process of (E)-alpha-Ethylidenepiperidine-1-acetaldehyde

There total 4 articles about (E)-alpha-Ethylidenepiperidine-1-acetaldehyde 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:

piperidine (110-89-4) + α-chlorocrotonaldehyde (25129-61-7) → N-Formylpiperidine (2591-86-8) + 2-Piperidinobut-2-enal (52900-92-2) + E-2-Piperidino-2-butenal (52900-93-3) + 1,2-dipiperidino-ethene (22039-42-5)

Guidance literature:

In tetrahydrofuran; Yields of byproduct given. Title compound not separated from byproducts; Ambient temperature;

DOI:10.1055/s-1989-27282

Reference yield:

piperidine (110-89-4) + (Z)-2-bromobut-2-enal (33718-99-9,24247-53-8,55947-13-2) → N-Formylpiperidine (2591-86-8) + 2-Piperidinobut-2-enal (52900-92-2) + E-2-Piperidino-2-butenal (52900-93-3) + 1,2-dipiperidino-ethene (22039-42-5)

Guidance literature:

In diethyl ether; Yields of byproduct given. Title compound not separated from byproducts; Ambient temperature;

DOI:10.1055/s-1989-27282

Reference yield:

piperidine (110-89-4) + 2-chloro-2-butenal (53175-28-3) → 2-Piperidinobut-2-enal (52900-92-2) + E-2-Piperidino-2-butenal (52900-93-3) + 2-chloro-1-hydroxy-1,3-dipiperidinobutane + 2,3-dipiperidinobutanal + 1-hydroxy-1,2,3-tripiperidinobutane

Guidance literature:

In benzene-d6; at 5 - 25 ℃; Mechanism;

DOI:10.1007/BF01433746

upstream raw materials:

piperidine

α-chlorocrotonaldehyde

(Z)-2-bromobut-2-enal

2-chloro-2-butenal

Downstream raw materials:

C₁₈H₂₂N₂O₆S₂

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