4-Phenoxypiperidine

Base Information

• Chemical Name: 4-Phenoxypiperidine
• CAS No.: 3202-33-3
• Molecular Formula: C11H15NO
• Molecular Weight: 177.246
• Hs Code.: 2933399090
• European Community (EC) Number: 681-811-2
• UNII: AOF4M4L61Z
• Wikidata: Q27274035
• ChEMBL ID: CHEMBL3904359
• Mol file: 3202-33-3.mol

Synonyms:4-phenoxypiperidine;3202-33-3;Piperidine, 4-phenoxy-;4-Phenoxy-piperidine;MFCD04114971;UNII-AOF4M4L61Z;AOF4M4L61Z;CHEMBL3904359;4-(phenoxy)piperidine;SCHEMBL211130;AMY5285;KBYPITRKIJKGMD-UHFFFAOYSA-N;MFCD0411497;AC5887;BDBM50202730;AKOS000184064;SB36568;PD158979;SY026648;A5764;BB 0253380;CS-0156070;FT-0650323;EN300-49863;10Y-7007;J-515927;Q27274035;(R,S)-2-AMINO-3-[3-(CARBOXYMETHOXY)-5-METHYL-ISOXAZOL-4-YL]-PROPIONICACID,SESQUIHYDRATE

Chemical Property of 4-Phenoxypiperidine

Chemical Property:

• Vapor Pressure: 0.0043mmHg at 25°C
• Refractive Index: 1.524
• Boiling Point: 278.3 °C at 760 mmHg
• PKA: 9.62±0.10(Predicted)
• Flash Point: 110.1 °C
• PSA: 21.26000
• Density: 1.03 g/cm³
• LogP: 2.14620
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• XLogP3: 2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 177.115364102
• Heavy Atom Count: 13
• Complexity: 137

Purity/Quality:

99% ^*data from raw suppliers

4-Phenoxypiperidine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CNCCC1OC2=CC=CC=C2

Technology Process of 4-Phenoxypiperidine

There total 6 articles about 4-Phenoxypiperidine 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: 96.0%

tert-butyl 4-phenoxypiperidine-1-carboxylate (155989-69-8) → 4-phenoxypiperidine (3202-33-3)

Guidance literature:

With trifluoroacetic acid; In dichloromethane; at 20 ℃; for 2.5h;

DOI:10.3390/molecules22101688

Reference yield: 66.0%

4-HYDROXYPIPERIDINE (5382-16-1) + methylphenylsulfonate (3112-85-4) → 4-phenoxypiperidine (3202-33-3)

Guidance literature:

With potassium tert-butylate; In dimethyl sulfoxide; at 80 ℃; for 56h; chemoselective reaction; Inert atmosphere; Sealed tube;

DOI:10.1021/acs.orglett.1c01926

Reference yield:

4-phenoxypyridine (4783-86-2) + benzyl bromide (100-39-0) → 4-phenoxypiperidine (3202-33-3)

Guidance literature:

Pd-C; In methanol; acetone;

upstream raw materials:

tert-butyl 4-phenoxypiperidine-1-carboxylate

4-HYDROXYPIPERIDINE

t-butyl 4-hydroxy piperidine-1-carboxylate

4-phenoxypyridine

Downstream raw materials:

3-(4-phenoxypiperidin-1-yl)propan-1-ol

4-phenoxy-1-[4-(tetrahydro-pyran-2-yloxy)-phenyl]-piperidine

4-(4-phenoxypiperidin-1-yl)phenol

Refernces

• 1、 -. "6,5-FUSED HETEROARYL PIPERIDINE ETHER ALLOSTERIC MODULATORS OF THE M4 MUSCARINIC ACETYLCHOLINE RECEPTOR". Page/Page column 48. . Retrieved 2018/07/29.
• 2、 Kiesewetter, Dale O.,Eckelman, William C.. "Utility of azetidinium methanesulfonates for radiosynthesis of 3-[ 18F]fluoropropyl amines". . p. 953 - 969. Retrieved 2007/10/03.