Methyl 4-(3,4-diaminophenoxy)benzoate

Base Information

• Chemical Name: Methyl 4-(3,4-diaminophenoxy)benzoate
• CAS No.: 24002-80-0
• Molecular Formula: C14H14N2O3
• Molecular Weight: 258.2726
• Hs Code.: 2922509090
• DSSTox Substance ID: DTXSID40377223
• Wikidata: Q82166365
• Mol file: 24002-80-0.mol

Synonyms:24002-80-0;methyl 4-(3,4-diaminophenoxy)benzoate;methyl 4-(3,4-diaminophenoxy)benzenecarboxylate;Oprea1_460207;DTXSID40377223;MFCD03425779;AKOS005070486;SB81418;CS-0336276;FT-0680394;4T-0326;A878064

Chemical Property of Methyl 4-(3,4-diaminophenoxy)benzoate

Chemical Property:

• Vapor Pressure: 9.11E-08mmHg at 25°C
• Melting Point: 92-95 °C
• Refractive Index: 1.639
• Boiling Point: 434.9 °C at 760 mmHg
• PKA: 4.03±0.10(Predicted)
• Flash Point: 209.8 °C
• PSA: 87.57000
• Density: 1.275 g/cm³
• LogP: 3.59230
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 258.10044231
• Heavy Atom Count: 19
• Complexity: 303

Purity/Quality:

95% ^*data from raw suppliers

Methyl 4-(3,4-diaminophenoxy)benzenecarboxylate >95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1=CC=C(C=C1)OC2=CC(=C(C=C2)N)N

Technology Process of Methyl 4-(3,4-diaminophenoxy)benzoate

There total 1 articles about Methyl 4-(3,4-diaminophenoxy)benzoate 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:

→ Methylester von 3,4-Diaminodiphenylether-4'-carbonsaeure (24002-80-0)

Guidance literature:

aus dem entspr. Nitroderivat (III) bei der Reduktion mit Fe/wss. HCl in Ethylenglykol bei 120grad;

Reference yield: 90.0%

Methylester von 3,4-Diaminodiphenylether-4'-carbonsaeure (24002-80-0) + acetone (67-64-1) → methyl 4-(2,2-dimethyl-2H-benzo[d]imidazol-5-yloxy)benzoate

Guidance literature:

With copper diacetate; In ethanol; at 25 ℃; for 8h; Green chemistry;

DOI:10.1039/c3gc41585f