4-(2-Iodobenzyl)morpholine

Base Information

• Chemical Name: 4-(2-Iodobenzyl)morpholine
• CAS No.: 156333-95-8
• Molecular Formula: C11H14 I N O
• Molecular Weight: 303.143
• DSSTox Substance ID: DTXSID60456342
• Wikidata: Q82278746
• Mol file: 156333-95-8.mol

Synonyms:4-(2-Iodobenzyl)morpholine;156333-95-8;4-[(2-iodophenyl)methyl]morpholine;SCHEMBL16140192;DTXSID60456342;MFCD06797850;FT-0718728

Chemical Property of 4-(2-Iodobenzyl)morpholine

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 46 °C
• Refractive Index: 1.612
• Boiling Point: 331.3°Cat760mmHg
• Flash Point: 154.2°C
• PSA: 12.47000
• Density: 1.604g/cm³
• LogP: 2.06130
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 303.01201
• Heavy Atom Count: 14
• Complexity: 171

Purity/Quality:

98%min ^*data from raw suppliers

4-(2-IODOBENZYL)MORPHOLINE ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1COCCN1CC2=CC=CC=C2I

Technology Process of 4-(2-Iodobenzyl)morpholine

There total 2 articles about 4-(2-Iodobenzyl)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: 92.0%

morpholine (110-91-8,99108-56-2) + 2-(chloromethyl)iodobenzene (59473-45-9) → 2-(N-morpholylmethyl)-iodobenzene (156333-95-8)

Guidance literature:

In toluene; Heating;

DOI:10.1016/S0040-4020(01)85682-9

Reference yield: 72.0%

morpholine (110-91-8,99108-56-2) + carbon monoxide (201230-82-2) + 2-Iodobenzyl bromide (40400-13-3) → 2-(N-morpholylmethyl)-N,N-(3-oxapentane-1,5-diyl)benzamide (1268618-99-0) + 2-(N-morpholylmethyl)-iodobenzene (156333-95-8)

Guidance literature:

With palladium diacetate; triethylamine; triphenylphosphine; In N,N-dimethyl-formamide; at 50 ℃; for 24h; under 750.075 Torr;

DOI:10.1016/j.tet.2010.11.099

Reference yield: 71.0%

2-(N-morpholylmethyl)-iodobenzene (156333-95-8) → 4-benzyl-morpholine (10316-00-4)

Guidance literature:

With TETRAHYDROPYRANE; N,N,N,N,N,N-hexamethylphosphoric triamide; samarium diiodide; pentan-3-one; at -10 ℃; for 4h;

DOI:10.1016/0040-4020(95)00081-I

upstream raw materials:

morpholine

2-(chloromethyl)iodobenzene

carbon monoxide

2-Iodobenzyl bromide

Downstream raw materials:

4-benzyl-morpholine