Ethyl 1-(2-formylphenyl)piperidine-4-carboxylate

Base Information

• Chemical Name: Ethyl 1-(2-formylphenyl)piperidine-4-carboxylate
• CAS No.: 259683-56-2
• Molecular Formula: C₁₅H₁₉NO₃
• Molecular Weight: 261.321
• Hs Code.: 2933399090
• European Community (EC) Number: 810-545-3
• DSSTox Substance ID: DTXSID30383974
• Wikidata: Q82175823
• Mol file: 259683-56-2.mol

Synonyms:ethyl 1-(2-formylphenyl)piperidine-4-carboxylate;259683-56-2;1-(2-FORMYLPHENYL)PIPERIDINE-4-CARBOXYLIC ACID ETHYL ESTER;1-(2-Formylphenyl)piperidine-4-carboxylic acid ethyl. ester;Ethyl1-(2-formylphenyl)piperidine-4-carboxylate;SCHEMBL18914464;DTXSID30383974;MFCD00662563;AKOS015914497;DS-2023;PS-4638;SB43141;CS-0299069;FT-0659818;EN300-731432;A818116;J-520484;4-Piperidinecarboxylic acid, 1-(2-formylphenyl)-, ethyl ester

Chemical Property of Ethyl 1-(2-formylphenyl)piperidine-4-carboxylate

Chemical Property:

• Vapor Pressure: 2.1E-06mmHg at 25°C
• Boiling Point: 393.6°Cat760mmHg
• Flash Point: 191.9°C
• PSA: 46.61000
• Density: 1.148g/cm³
• LogP: 2.34360
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 261.13649347
• Heavy Atom Count: 19
• Complexity: 311

Purity/Quality:

97% ^*data from raw suppliers

Ethyl 1-(2-formylphenyl)piperidine-4-carboxylate ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1CCN(CC1)C2=CC=CC=C2C=O

Technology Process of Ethyl 1-(2-formylphenyl)piperidine-4-carboxylate

There total 1 articles about Ethyl 1-(2-formylphenyl)piperidine-4-carboxylate 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:

4-carbethoxypiperidine (1126-09-6) + 2-Fluorobenzaldehyde (446-52-6) → C15H19NO3 (259683-56-2)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 140 ℃; for 14.5h;

Reference yield:

C15H19NO3 (259683-56-2) → C15H21NO3 (773870-63-6)

Guidance literature:

C₁₅H₁₉NO₃; With sodium tetrahydroborate; In ethanol; for 1h; Cooling with ice;

With acetic acid; In ethanol;

Reference yield:

C15H19NO3 (259683-56-2) → C15H20ClNO2*ClH

Guidance literature:

Multi-step reaction with 2 steps

1: sodium tetrahydroborate / ethanol / 1 h / Cooling with ice

2: thionyl chloride / chloroform / 15 h / 20 °C / Cooling with ice

With sodium tetrahydroborate; thionyl chloride; In ethanol; chloroform;

upstream raw materials:

4-carbethoxypiperidine

2-Fluorobenzaldehyde

Downstream raw materials:

C₁₅H₂₁NO₃