4-Piperidin-1-ium-1-ylbutanoate

Base Information

• Chemical Name: 4-Piperidin-1-ium-1-ylbutanoate
• CAS No.: 4672-16-6
• Molecular Formula: C9H17NO2
• Molecular Weight: 171.239
• Mol file: 4672-16-6.mol

Synonyms:

Chemical Property of 4-Piperidin-1-ium-1-ylbutanoate

Chemical Property:

• Vapor Pressure: 0.000169mmHg at 25°C
• Boiling Point: 306.9°C at 760 mmHg
• Flash Point: 139.4°C
• PSA: 40.54000
• Density: 1.052g/cm³
• LogP: 1.27500
• XLogP3: -0.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 171.125928785
• Heavy Atom Count: 12
• Complexity: 136

Purity/Quality:

95% ^*data from raw suppliers

4-(Piperidin-1-yl)butanoicacid 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CC[NH+](CC1)CCCC(=O)[O-]

Technology Process of 4-Piperidin-1-ium-1-ylbutanoate

There total 6 articles about 4-Piperidin-1-ium-1-ylbutanoate 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: 95.0%

methyl 4-(piperidin-1-yl) butanoate (63867-69-6) → 4-piperidin-1-ylbutanoic acid (4672-16-6)

Guidance literature:

With water; In methanol; Alkaline conditions;

DOI:10.3390/molecules23112984

Reference yield:

(piperidinyl-1)-4 butanoate d'ethyle (116885-98-4) → 4-piperidin-1-ylbutanoic acid (4672-16-6)

Guidance literature:

With diethyl ether; sodium ethanolate; benzene; Anschliessendes Behandeln mit Essigsaeure;

DOI:10.1021/ja01323a050

Reference yield:

piperidine (110-89-4) → 4-piperidin-1-ylbutanoic acid (4672-16-6)

Guidance literature:

Multi-step reaction with 2 steps

2: fuming hydrochloric acid / 100 °C / im Rohr

With hydrogenchloride;

upstream raw materials:

4-(piperidin-1-yl)butyronitrile

(piperidinyl-1)-4 butanoate d'ethyle

piperidine

methyl 4-(piperidin-1-yl) butanoate

Downstream raw materials:

N-[5-(2-difluoromethoxyphenyl)-2H-pyrazol-3-yl]-4-piperidin-1-yl-butyramide formate salt

[5-(4-methoxyphenyl)-2H-pyrazol-3-yl](4-piperidin-1-yl-butyl)amine

N-[5-(4-chloro-2-methylphenyl)-2H-pyrazol-3-yl]-4-piperidin-1-ylbutyramide formate salt

N-[5-(5-chloro-2-methylphenyl)-2H-pyrazol-3-yl]-4-piperidin-1-ylbutyramide formate salt

Refernces

• 1、 Saleh, Maysaa M.,Laughton, Charles A.,Bradshaw, Tracey D.,Moody, Christopher J.. "Development of a series of bis-triazoles as G-quadruplex ligands". . p. 47297 - 47308. Retrieved 2017/10/19.
• 2、 -. "ALPHA7 NICOTINIC ACETYLCHOLINE RECEPTOR INHIBITORS". Page/Page column 134. . Retrieved 2010/04/03.