3-(Piperidin-2-yl)propanoic acid

Base Information

• Chemical Name: 3-(Piperidin-2-yl)propanoic acid
• CAS No.: 4088-33-9
• Molecular Formula: C8H15NO2
• Molecular Weight: 157.2102
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID70557753
• Mol file: 4088-33-9.mol

Synonyms:3-(piperidin-2-yl)propanoic acid;4088-33-9;3-PIPERIDIN-2-YL-PROPIONIC ACID;3-Piperidin-2-ylpropanoic acid;3-(2-piperidinyl)propanoic acid;3-Piperidin-2-yl-propionicacid;SCHEMBL3653626;3-(piperidin-2-yl)propanoicacid;DTXSID70557753;3-(Piperidin-2-Yl)propionic Acid;MFCD03412487;3-[(2R)-2-piperidyl]propanoic acid;3-[(2S)-2-piperidyl]propanoic acid;AKOS005606023;SB41927;AM100796;AS-39279;A6813;CS-0216800;EN300-61315;F8889-0891

Chemical Property of 3-(Piperidin-2-yl)propanoic acid

Chemical Property:

• Vapor Pressure: 0.000284mmHg at 25°C
• Refractive Index: 1.466
• Boiling Point: 299.4 °C at 760 mmHg
• PKA: 4.46±0.10(Predicted)
• Flash Point: 134.9 °C
• PSA: 49.33000
• Density: 1.039 g/cm³
• LogP: 1.32210
• Storage Temp.: 2-8°C
• XLogP3: -1.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 157.110278721
• Heavy Atom Count: 11
• Complexity: 136

Purity/Quality:

98% ^*data from raw suppliers

3-(Piperidin-2-yl)propanoicacid 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 22-36
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCNC(C1)CCC(=O)O
• Uses: 3-(Piperidin-2-yl)propanoic acid is a synthetic analog of GABA(A602920), and used in studies to analyze the inhibition of [3H]?GABA binding to postsynaptic receptors in human cerebellar synaptic membranes.

Technology Process of 3-(Piperidin-2-yl)propanoic acid

There total 4 articles about 3-(Piperidin-2-yl)propanoic acid 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:

(E)-ethyl 3-(2-pyridyl)-propenoate (7340-23-0,33788-40-8,70526-11-3) → 2-(2-Carboxy-ethyl)-piperidin (4088-33-9)

Guidance literature:

With ethanol; nickel; at 160 ℃; under 88260.9 Torr; Hydrogenation_.Erhitzen des Reaktionsprodukts mit wss. HCl;

Reference yield:

(E)-3-(2-pyridyl)acrylic acid (54495-51-1) → 2-(2-Carboxy-ethyl)-piperidin (4088-33-9)

Guidance literature:

With acetic acid; platinum; Hydrogenation;

DOI:10.1021/jo50001a012

Reference yield:

→ 2-(2-Carboxy-ethyl)-piperidin (4088-33-9)

Guidance literature:

With hydrogenchloride;

upstream raw materials:

(E)-3-(2-pyridyl)acrylic acid

(E)-ethyl 3-(2-pyridyl)-propenoate

Refernces

• 1、 -. "Tetrapyrrole therapeutic agents". . . Retrieved 2008/06/13.