2-(Piperidin-1-yl)acetic acid hydrochloride

Base Information

• Chemical Name: 2-(Piperidin-1-yl)acetic acid hydrochloride
• CAS No.: 3235-68-5
• Molecular Formula: C7H14ClNO2
• Molecular Weight: 179.647
• Hs Code.: 2933399090
• European Community (EC) Number: 817-498-8
• DSSTox Substance ID: DTXSID60186071
• ChEMBL ID: CHEMBL1546923
• Mol file: 3235-68-5.mol

Synonyms:3235-68-5;2-(piperidin-1-yl)acetic acid hydrochloride;Piperidin-1-yl-acetic acid hydrochloride;1-Piperidineacetic acid, hydrochloride;Piperidinoacetic acid hydrochloride;(Piperidin-1-yl)acetic acid hydrochloride;2-(Piperidin-1-yl)acetic acid, HCl;N-Carboxymethylpiperidine hydrochloride;Piperidin-1-ylacetic acid hydrochloride;2-piperidin-1-ylacetic acid;hydrochloride;C7H13NO2.ClH;1-Piperidineacetic acid HCl;MLS000715451;SCHEMBL863867;CHEMBL1546923;DTXSID60186071;1-piperidineacetic acid hydrochloride;MFCD01701566;AKOS005144261;PS-8543;SB41409;Piperidin-1-vl acetic acid hydrochloride;Piperidin-1-yl acetic acid hydrochloride;2-(piperidin-1-yl)aceticacidhydrochloride;SMR000275430;LS-114110;1-PIPERIDINYLACETIC ACID HYDROCHLORIDE;FT-0677174;EN300-41519;D97813;A875644;F2130-0041;Z1171978832

Chemical Property of 2-(Piperidin-1-yl)acetic acid hydrochloride

Chemical Property:

• Vapor Pressure: 0.00615mmHg at 25°C
• Boiling Point: 252.2°Cat760mmHg
• Flash Point: 106.3°C
• PSA: 40.54000
• Density: g/cm³
• LogP: 1.29680
• Storage Temp.: Inert atmosphere,Room Temperature
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 179.0713064
• Heavy Atom Count: 11
• Complexity: 119

Purity/Quality:

97% ^*data from raw suppliers

2-(Piperidin-1-yl)aceticAcidHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1CCN(CC1)CC(=O)O.Cl

Technology Process of 2-(Piperidin-1-yl)acetic acid hydrochloride

There total 5 articles about 2-(Piperidin-1-yl)acetic acid hydrochloride 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: 97.0%

piperidin-1-yl-acetic acid ethyl ester (23853-10-3) → piperidin-1-yl-acetic acid hydrochloride (3235-68-5)

Guidance literature:

With hydrogenchloride; In water; for 16h; Reflux;

DOI:10.1021/jacs.7b05619

Reference yield: 56.0%

piperidine (110-89-4) + bromoacetic acid tert-butyl ester (5292-43-3) → piperidin-1-yl-acetic acid hydrochloride (3235-68-5)

Guidance literature:

In tetrahydrofuran; hydrogenchloride; ethyl acetate;

Reference yield:

piperidine (110-89-4) → piperidin-1-yl-acetic acid hydrochloride (3235-68-5)

Guidance literature:

Multi-step reaction with 2 steps

1: diethyl ether / 16 h / 20 °C

2: hydrogenchloride / water / 16 h / Reflux

With hydrogenchloride; In diethyl ether; water;

DOI:10.1021/jacs.7b05619

upstream raw materials:

piperidin-1-yl-acetic acid ethyl ester

piperidine

bromoacetic acid tert-butyl ester

Downstream raw materials:

4-acetamidophenyl 2-(piperidin-1-yl)acetate

4-acetamidophenyl 2-(piperidin-1-yl)acetate hydrochloride