4-(4-Fluoro-phenyl)-morpholine

Base Information

• Chemical Name: 4-(4-Fluoro-phenyl)-morpholine
• CAS No.: 4280-40-4
• Molecular Formula: C10H12FNO
• Molecular Weight: 181.21
• Hs Code.: 2934999090
• European Community (EC) Number: 866-187-3
• DSSTox Substance ID: DTXSID90463307
• Nikkaji Number: J2.858.831C
• Wikidata: Q82288161
• Mol file: 4280-40-4.mol

Synonyms:4-(4-fluorophenyl)morpholine;4280-40-4;4-(4-Fluoro-phenyl)-morpholine;SCHEMBL4972149;DTXSID90463307;AKOS006283913;AC-17780;EN300-25395417;Z1198182900

Chemical Property of 4-(4-Fluoro-phenyl)-morpholine

Chemical Property:

• Vapor Pressure: 0.00197mmHg at 25°C
• Melting Point: 53-54 °C
• Boiling Point: 291.3oC at 760 mmHg
• PKA: 5.26±0.40(Predicted)
• Flash Point: 129.9oC
• PSA: 12.47000
• Density: 1.154g/cm3
• LogP: 1.72730
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 181.090292168
• Heavy Atom Count: 13
• Complexity: 151

Purity/Quality:

4-(4-FLUORO-PHENYL)-MORPHOLINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1COCCN1C2=CC=C(C=C2)F

Technology Process of 4-(4-Fluoro-phenyl)-morpholine

There total 18 articles about 4-(4-Fluoro-phenyl)-morpholine 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: 98.0%

morpholine (110-91-8,99108-56-2) + 1-Chloro-4-fluorobenzene (352-33-0) → 4-(4-fluorophenyl)morpholine (4280-40-4)

Guidance literature:

With Pd-PEPPSI-IPr^An; potassium tert-butylate; In 1,4-dioxane; at 80 ℃; for 24h; Inert atmosphere;

DOI:10.1039/c1cc15503b

Reference yield: 97.0%

4-morpholinecarboxaldehyde (4394-85-8) + 1-Chloro-4-fluorobenzene (352-33-0) → 4-(4-fluorophenyl)morpholine (4280-40-4)

Guidance literature:

With NHC-Pd(II)-Im; potassium tert-butylate; In tetrahydrofuran; at 20 ℃; for 6h; Inert atmosphere;

DOI:10.1021/jo301811n DOI:10.1021/jo301811n

Reference yield: 96.0%

morpholine (110-91-8,99108-56-2) + 2-(4-fluorophenoxy)pyridine (1173294-78-4) → 4-(4-fluorophenyl)morpholine (4280-40-4)

Guidance literature:

With bis(1,5-cyclooctadiene)nickel ⁽⁰⁾; lithium tert-butoxide; 1,3-bis[2,6-bis(1-methylethyl)phenyl]-1,3-dihydro-2H-imidazol-2-ylidene monohydrochloride; In 1,4-dioxane; at 100 ℃; for 12h; Schlenk technique; Inert atmosphere;

DOI:10.1021/acs.orglett.7b01549

upstream raw materials:

morpholine

4-chlorobenzonitrile

2,2,2-trifluoroethanol

4-(4-morpholino)phenyldiazonium tetrafluoroborate

Downstream raw materials:

4-(morpholino)biphenyl