2-Morpholinobenzaldehyde

Base Information

• Chemical Name: 2-Morpholinobenzaldehyde
• CAS No.: 58028-76-5
• Molecular Formula: C11H13NO2
• Molecular Weight: 191.23
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID00371767
• Nikkaji Number: J2.226.120G
• Wikidata: Q72493080
• Mol file: 58028-76-5.mol

Synonyms:2-Morpholinobenzaldehyde;58028-76-5;2-Morpholin-4-yl-benzaldehyde;2-morpholin-4-ylbenzaldehyde;2-(4-Morpholino)Benzaldehyde;2-morpholinobenzenecarbaldehyde;2-(morpholin-4-yl)benzaldehyde;Benzaldehyde, 2-(4-morpholinyl)-;MFCD00662562;Morpholinobenzaldehyde;SCHEMBL136563;2-(4-morpholinyl)benzaldehyde;DTXSID00371767;GTTAEWVBVHSDLX-UHFFFAOYSA-N;2-morpholinobenzaldehyde, AldrichCPR;AKOS000260481;AA-0711;AC-2643;SY002373;AM20061132;CS-0045035;FT-0613103;EN300-29917;A22700;J-510128;Z235361311

Chemical Property of 2-Morpholinobenzaldehyde

Chemical Property:

• Vapor Pressure: 7.34E-05mmHg at 25°C
• Melting Point: 45-48°C
• Refractive Index: 1.581
• Boiling Point: 342.8 °C at 760 mmHg
• PKA: 3.88±0.40(Predicted)
• Flash Point: 161.1 °C
• PSA: 29.54000
• Density: 1.163g/cm³
• LogP: 1.40070
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 191.094628657
• Heavy Atom Count: 14
• Complexity: 190

Purity/Quality:

97% ^*data from raw suppliers

2-Morpholinobenzaldehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 52
• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1COCCN1C2=CC=CC=C2C=O
• Uses: Benzaldehyde derivative.

Technology Process of 2-Morpholinobenzaldehyde

There total 3 articles about 2-Morpholinobenzaldehyde 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: 87.0%

morpholine (110-91-8,99108-56-2) + 2-Fluorobenzaldehyde (446-52-6) → 2-(morpholin-4-yl)benzaldehyde (58028-76-5)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 150 ℃; for 20h;

DOI:10.1023/B:RUCB.0000042280.71728.d0

Reference yield: 43.0%

→ 2-(morpholin-4-yl)benzaldehyde (58028-76-5)

Guidance literature:

Reference yield:

morpholine (110-91-8,99108-56-2) → 2-(morpholin-4-yl)benzaldehyde (58028-76-5)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; for 12h; Reflux;

DOI:10.1021/acs.orglett.9b03011

upstream raw materials:

morpholine

2-Fluorobenzaldehyde

Downstream raw materials:

4-(2-morpholin-4-yl-benzylidene)-2-phenyl-4H-oxazol-5-one

bis-(2-morpholin-4-yl-benzylidene)-hydrazine

(E)-3-(2-morpholinophenyl)acrylic acid

4-[2-((E)-2-Methyl-but-1-enyl)-phenyl]-morpholine