3-Phenoxypiperidine

Base Information

• Chemical Name: 3-Phenoxypiperidine
• CAS No.: 151666-08-9
• Molecular Formula: C11H15NO
• Molecular Weight: 177.246
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID20395642
• Mol file: 151666-08-9.mol

Synonyms:3-phenoxypiperidine;151666-08-9;3-Phenoxy-piperidine;MFCD04117746;Piperidine, 3-phenoxy-;Piperidine,3-phenoxy-;3-PHENOXYPIPERIDINE,;SCHEMBL1228429;DTXSID20395642;QDPNIJKUTWDGMV-UHFFFAOYSA-N;AKOS005263789;AM84965;SB33813;NS-01509;A3333;CS-0131731;FT-0649077;EN300-76552;J-513027

Chemical Property of 3-Phenoxypiperidine

Chemical Property:

• Vapor Pressure: 0.0043mmHg at 25°C
• Refractive Index: 1.524
• Boiling Point: 278.3 °C at 760 mmHg
• PKA: 8.99±0.10(Predicted)
• Flash Point: 110.1 °C
• PSA: 21.26000
• Density: 1.03 g/cm³
• LogP: 2.14620
• 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: 143

Purity/Quality:

98%min ^*data from raw suppliers

3-phenoxypiperidine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(CNC1)OC2=CC=CC=C2

Technology Process of 3-Phenoxypiperidine

There total 1 articles about 3-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: 43.0%

→ 3-phenoxypiperidine (151666-08-9)

Guidance literature:

Reference yield: 68.0%

3-phenoxypiperidine (151666-08-9) + (Z)-4-(3-carbamoylphenylamino)-4-oxobut-2-enoic acid (1394131-74-8) → MCD-75

Guidance literature:

3-phenoxypiperidine; (Z)-4-(3-carbamoylphenylamino)-4-oxobut-2-enoic acid; With N-ethyl-N,N-diisopropylamine; In N,N-dimethyl-formamide; Inert atmosphere;

With HATU; In N,N-dimethyl-formamide; for 1h; Inert atmosphere;

DOI:10.1016/j.bmcl.2017.04.089

Reference yield:

3-phenoxypiperidine (151666-08-9) + (4-(5-methoxy-5-oxopentyl)phenyl)boronic acid → C23H29NO3

Guidance literature:

3-phenoxypiperidine; (4-(5-methoxy-5-oxopentyl)phenyl)boronic acid; With pyridine; In dichloromethane; at 20 ℃; for 0.25h; Molecular sieve;

With copper diacetate; for 18h; Reflux;

Downstream raw materials:

C₂₆H₄₀N₂O₆

Refernces