2-(Piperidine-1-carbonyl)benzaldehyde

Base Information

• Chemical Name: 2-(Piperidine-1-carbonyl)benzaldehyde
• CAS No.: 84538-49-8
• Molecular Formula: C₁₃H₁₅NO₂
• Molecular Weight: 217.268
• European Community (EC) Number: 834-038-1
• Nikkaji Number: J1.224.628E
• Mol file: 84538-49-8.mol

Synonyms:2-(piperidine-1-carbonyl)benzaldehyde;84538-49-8;starbld0015658;SCHEMBL22551122;MFCD16037343;P2750;EN300-6736678;Z1067995168

Chemical Property of 2-(Piperidine-1-carbonyl)benzaldehyde

Chemical Property:

• XLogP3: 1.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 217.110278721
• Heavy Atom Count: 16
• Complexity: 259

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

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

Technology Process of 2-(Piperidine-1-carbonyl)benzaldehyde

There total 9 articles about 2-(Piperidine-1-carbonyl)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: 65.0%

piperidine (110-89-4) + 3-Bromophthalide (6940-49-4) → 2-(piperidine-1-carbonyl)benzaldehyde (84538-49-8)

Guidance literature:

In acetone; at 20 ℃; for 1h;

Reference yield: 61.0%

piperidine (110-89-4) + 3-chloro-1(3H)-isobenzofuranone (6295-21-2) → 2-(piperidine-1-carbonyl)benzaldehyde (84538-49-8)

Guidance literature:

In acetone; for 1h; Ambient temperature;

DOI:10.1021/jo00153a002

Reference yield: 40.0%

piperidine (110-89-4) + o-phthalic dicarboxaldehyde (643-79-8) → 2-(piperidine-1-carbonyl)benzaldehyde (84538-49-8) + o-carboxybenzaldehyde (119-67-5)

Guidance literature:

With potassium tetrachloroaurate(III); potassium carbonate; In water; acetonitrile; at 40 ℃; for 12h;

DOI:10.1039/c2cc17689k

upstream raw materials:

piperidine

3-chloro-1(3H)-isobenzofuranone

3-Iodo-1(3H)-isobenzofuranone

3-Bromophthalide

Refernces

• 1、 Lin, Yun,Zhu, Lei,Lan, Yu,Rao, Yu. "Development of a Rhodium(II)-Catalyzed Chemoselective C(sp3)-H Oxygenation". supporting information. p. 14937 - 14942. Retrieved 2015/10/19.
• 2、 Desai,Chaphekar,Samant. "The investigation of nucleophilic reactions of 3 -bromo/chloro phthalide with amines". . p. 810 - 813. Retrieved 2007/10/03.