3-Piperidineacetic acid

Base Information

• Chemical Name: 3-Piperidineacetic acid
• CAS No.: 74494-52-3
• Molecular Formula: C7H13NO2
• Molecular Weight: 143.186
• Hs Code.: 2933399090
• NSC Number: 138735
• DSSTox Substance ID: DTXSID00300759
• Nikkaji Number: J693.917A
• Mol file: 74494-52-3.mol

Synonyms:74494-52-3;3-Piperidineacetic acid;2-(Piperidin-3-yl)acetic acid;3-piperidine acetic acid;Piperidin-3-yl-acetic acid;2-piperidin-3-ylacetic acid;piperidin-3-ylacetic acid;2-(3-piperidyl)acetic acid;(R)-Piperidine-3-aceticAcid;3-Piperidineacetic Acid-d11;3-PIPERIDINYLACETIC ACID;MFCD06410646;3-PIPERIDINEACETICACID;Piperidine-3-acetic acid;SCHEMBL1225755;DTXSID00300759;MFCD13190257;NSC138735;AKOS011984407;AB70074;AB70075;NSC 138735;NSC-138735;PB14441;1260609-67-3;AM101219;AS-31697;SY002542;SY129460;CS-0037060;FT-0727448;EN300-64771;A865882;F8887-4005

Chemical Property of 3-Piperidineacetic acid

Chemical Property:

• Vapor Pressure: 0.000659mmHg at 25°C
• Melting Point: 276-278 °C
• Refractive Index: 1.465
• Boiling Point: 286.8 °C at 760 mmHg
• PKA: 4.43±0.10(Predicted)
• Flash Point: 127.3 °C
• PSA: 49.33000
• Density: 1.063 g/cm³
• LogP: 0.78950
• Storage Temp.: 2-8°C
• Solubility.: DCM, Methanol, Water
• XLogP3: -2.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 143.094628657
• Heavy Atom Count: 10
• Complexity: 125

Purity/Quality:

98%,99%, ^*data from raw suppliers

3-Piperidineacetic Acid-d11 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(CNC1)CC(=O)O
• Uses: Isotope labelled 3-piperidineacetic acid, an GABA analog used in the study of synaptosome inhibition.

Technology Process of 3-Piperidineacetic acid

There total 1 articles about 3-Piperidineacetic 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:

→ pyridyl-3-yl-acetic acid (501-81-5) + 3-Piperidinylacetic Acid (74494-52-3)

Guidance literature:

Reference yield: 69.0%

3-Piperidinylacetic Acid (74494-52-3) → 3-(2-hydroxyethyl)piperidine (73579-06-3,115909-92-7)

Guidance literature:

With LiAlH; In tetrahydrofuran; for 4h; Heating;

DOI:10.1002/hlca.19870700802

Reference yield: 32.0%

3-(3-(4-chloro-5-fluoropyrimidin-2-yl)-1-(2-fluorobenzyl)-1H-pyrazol-5-yl)isoxazole (1446358-48-0) + 3-Piperidinylacetic Acid (74494-52-3) → C24H22F2N6O3

Guidance literature:

With N-ethyl-N,N-diisopropylamine; In tetrahydrofuran; water; at 120 ℃; for 18h;

Downstream raw materials:

3-(2-hydroxyethyl)piperidine

2-(1-(tert-butoxycarbonyl)piperidin-3-yl)acetic acid

(+)-(R)-1-(Benzyloxycarbonyl)piperidin-3-ethanol

(+)-(R)-1-(Benzyloxycarbonyl)piperidin-3-propionitril

Refernces