4-(2,5-Diethoxy-4-nitrophenyl)morpholine

Base Information

• Chemical Name: 4-(2,5-Diethoxy-4-nitrophenyl)morpholine
• CAS No.: 86-16-8
• Molecular Formula: C₁₄H₂₀N₂O₅
• Molecular Weight: 296.323
• European Community (EC) Number: 201-653-6
• UNII: 94M9VL2Q1H
• DSSTox Substance ID: DTXSID0044737
• Nikkaji Number: J39.634F
• Wikidata: Q27271696
• ChEMBL ID: CHEMBL3185665
• Mol file: 86-16-8.mol

Synonyms:4-(2,5-Diethoxy-4-nitrophenyl)morpholine;86-16-8;Morpholine, 4-(2,5-diethoxy-4-nitrophenyl)-;94M9VL2Q1H;DTXSID0044737;EINECS 201-653-6;CDS1_000315;Maybridge1_002603;UNII-94M9VL2Q1H;Oprea1_752599;DivK1c_001355;SCHEMBL6916262;CHEMBL3185665;DTXCID8024737;HMS548O07;Tox21_301452;AKOS015890018;CCG-233149;CAS-86-16-8;NCGC00256047-01;4-(2,5-diethoxy-4-nitrophenyl)morpholin;4-(2,5-diethoxy-4-nitrophenyl)-morpholine;FT-0619187;4-(2,5-Diethoxy-4-nitrophenyl)morpholine, 99%;W-111739;Q27271696;4-(2,5-Diethoxy-4-nitrophenyl)morpholine, purum, >=99.0% (GC)

Chemical Property of 4-(2,5-Diethoxy-4-nitrophenyl)morpholine

Chemical Property:

• Vapor Pressure: 3.28E-09mmHg at 25°C
• Melting Point: 139-141 ºC
• Refractive Index: 1.541
• Boiling Point: 475.6°C at 760 mmHg
• Flash Point: 241.4°C
• PSA: 76.75000
• Density: 1.206g/cm³
• LogP: 2.81700
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 296.13722174
• Heavy Atom Count: 21
• Complexity: 330

Purity/Quality:

98%min ^*data from raw suppliers

4-(2,5-DIETHOXY-4-NITROPHENYL)-MORPHOLINE Aldrich ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36-37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC1=CC(=C(C=C1N2CCOCC2)OCC)[N+](=O)[O-]

Technology Process of 4-(2,5-Diethoxy-4-nitrophenyl)morpholine

There total 3 articles about 4-(2,5-Diethoxy-4-nitrophenyl)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: 72.0%

morpholine (110-91-8,99108-56-2) + 4-Nitro-2,5-diethoxy-brombenzen (74127-06-3) → 4-Nitro-2,5-diethoxy-morpholinbenzen (86-16-8)

Guidance literature:

for 5h; Heating;

Reference yield:

2,5-diethoxy-1-nitrobenzene (119-23-3) → 4-Nitro-2,5-diethoxy-morpholinbenzen (86-16-8)

Guidance literature:

Multi-step reaction with 2 steps

1: 34 percent Spectr_. / bromination agent

2: 72 percent / 5 h / Heating

With bromination agent;

Reference yield:

5-nitro-2-amino-1,4-diethoxy-benzene (56185-25-2) → 4-Nitro-2,5-diethoxy-morpholinbenzen (86-16-8)

Guidance literature:

Multi-step reaction with 2 steps

1: 66 percent

2: 72 percent / 5 h / Heating

upstream raw materials:

morpholine

4-Nitro-2,5-diethoxy-brombenzen

2,5-diethoxy-1-nitrobenzene

5-nitro-2-amino-1,4-diethoxy-benzene

Refernces