4-(1-((Benzyloxy)carbonyl)piperidin-4-YL)butanoic acid

Base Information

• Chemical Name: 4-(1-((Benzyloxy)carbonyl)piperidin-4-YL)butanoic acid
• CAS No.: 204139-61-7
• Molecular Formula: C₁₇H₂₃NO₄
• Molecular Weight: 305.374
• Hs Code.: 2933399090
• European Community (EC) Number: 675-718-6
• DSSTox Substance ID: DTXSID60573508
• Wikidata: Q82462247
• Mol file: 204139-61-7.mol

Synonyms:204139-61-7;4-(1-Cbz-Piperidin-4-yl)-butyric acid;4-(1-((BENZYLOXY)CARBONYL)PIPERIDIN-4-YL)BUTANOIC ACID;1-cbz-4-(3-carboxy-propyl)-piperidine;4-(1-phenylmethoxycarbonylpiperidin-4-yl)butanoic acid;4-(3-carboxy-propyl)-piperidine-1-carboxylic acid benzyl ester;4-(1-((Benzyloxy)carbonyl)piperidin-4-yl)butanoicacid;4-{1-[(BENZYLOXY)CARBONYL]PIPERIDIN-4-YL}BUTANOIC ACID;4-(1-Cbz-Piperidin-4-yl)-butyricacid;4-PIPERIDINEBUTANOIC ACID, 1-[(PHENYLMETHOXY)CARBONYL]-;SCHEMBL7206044;DTXSID60573508;BZRPDNDVXWLKCX-UHFFFAOYSA-N;MFCD04114967;1-cbz-4-(3-carboxypropyl)piperidine;AKOS026670509;AB19349;AS-37247;CS-0171377;A13448;EN300-7410287;1-[(PHENYLMETHOXY)CARBONYL]-4-PIPERIDINEBUTANOIC ACID

Chemical Property of 4-(1-((Benzyloxy)carbonyl)piperidin-4-YL)butanoic acid

Chemical Property:

• Vapor Pressure: 5.04E-10mmHg at 25°C
• Refractive Index: 1.542
• Boiling Point: 480°Cat760mmHg
• Flash Point: 244.1°C
• PSA: 66.84000
• Density: 1.169g/cm³
• LogP: 3.22800
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 305.16270821
• Heavy Atom Count: 22
• Complexity: 358

Purity/Quality:

97% ^*data from raw suppliers

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

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CCC1CCCC(=O)O)C(=O)OCC2=CC=CC=C2

Technology Process of 4-(1-((Benzyloxy)carbonyl)piperidin-4-YL)butanoic acid

There total 3 articles about 4-(1-((Benzyloxy)carbonyl)piperidin-4-YL)butanoic 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: 81.0%

benzyl chloroformate (501-53-1,94274-21-2) + γ-(4-piperidyl)butyric acid hydrochloride → 4-(1-((benzyloxy)carbonyl)piperidin-4-yl)butanoic acid (204139-61-7)

Guidance literature:

benzyl chloroformate; γ-(4-piperidyl)butyric acid hydrochloride; With sodium hydroxide; In 1,4-dioxane; water; at 0 - 20 ℃; pH=9 - 10; Inert atmosphere;

With hydrogenchloride; In water; at -78 - 20 ℃; pH=0; Inert atmosphere;

DOI:10.1021/ja206047h

Reference yield: 55.0%

4-vinylpyridine (100-43-6,329041-72-7) + benzyl-N-succinimidyl carbonate + platinum (IV) oxide monohydrate + diethyl malonate (105-53-3) → 4-(1-((benzyloxy)carbonyl)piperidin-4-yl)butanoic acid (204139-61-7)

Guidance literature:

With hydrogenchloride; sodium hydroxide; In tetrahydrofuran; hydrogen;

Reference yield:

γ-(4-piperidyl)butyric acid hydrochloride → 4-(1-((benzyloxy)carbonyl)piperidin-4-yl)butanoic acid (204139-61-7)

Guidance literature:

γ-(4-piperidyl)butyric acid hydrochloride; With sodium hydroxide; In 1,4-dioxane; water; at 0 - 20 ℃; pH=9 - 10;

With hydrogenchloride; In water;

upstream raw materials:

4-vinylpyridine

diethyl malonate

benzyl chloroformate