(4-Ethoxy-3-methoxyphenyl)methanamine

Base Information

• Chemical Name: (4-Ethoxy-3-methoxyphenyl)methanamine
• CAS No.: 93489-14-6
• Molecular Formula: C10H15 N O2
• Molecular Weight: 181.235
• Hs Code.: 2922299090
• DSSTox Substance ID: DTXSID60427976
• Wikidata: Q82240737
• Mol file: 93489-14-6.mol

Synonyms:93489-14-6;(4-ethoxy-3-methoxyphenyl)methanamine;3-METHOXY-4-ETHOXYBENZYLAMINE;1-(4-ethoxy-3-methoxyphenyl)methanamine;(4-Ethoxy-3-methoxybenzyl)amine;4-ethoxy-3-methoxybenzylamine;Benzenemethanamine, 4-ethoxy-3-methoxy-;SCHEMBL5708146;DTXSID60427976;LMUGJOISPLJRRD-UHFFFAOYSA-N;MFCD07754789;STL255167;AKOS000141483;BS-17899;CS-0163379;EN300-39041;D84194

Chemical Property of (4-Ethoxy-3-methoxyphenyl)methanamine

Chemical Property:

• Melting Point: 48 °C
• Boiling Point: 279.8±25.0 °C(Predicted)
• PKA: 9.30±0.10(Predicted)
• PSA: 44.48000
• Density: 1.041±0.06 g/cm3(Predicted)
• LogP: 2.25290
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 181.110278721
• Heavy Atom Count: 13
• Complexity: 141

Purity/Quality:

99% ^*data from raw suppliers

(4-ethoxy-3-methoxyphenyl)methanamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC1=C(C=C(C=C1)CN)OC

Technology Process of (4-Ethoxy-3-methoxyphenyl)methanamine

There total 9 articles about (4-Ethoxy-3-methoxyphenyl)methanamine 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: 99.0%

C15H23NO4 (944256-01-3) → 4-ethoxy-3-methoxy-benzylamine (93489-14-6)

Guidance literature:

With trifluoroacetic acid; In dichloromethane; at 20 ℃; for 1h;

Reference yield: 95.0%

4-ethoxy-3-methoxybenzaldehyde (120-25-2) → 4-ethoxy-3-methoxy-benzylamine (93489-14-6)

Guidance literature:

With N,N'-bis(salicylidene)-1,2-phenylene-diaminocobalt(II); ammonia; hydrogen; In tetrahydrofuran; water; at 120 ℃; for 24h; Reagent/catalyst; Autoclave;

DOI:10.1039/c9sc04963k

Reference yield:

4-ethoxy-3-methoxybenzaldehyde (120-25-2) → 4-ethoxy-3-methoxy-benzylamine (93489-14-6) + N,N-bis-(4-ethoxy-3-methoxy-benzyl)-N'-phenyl-urea

Guidance literature:

With ethanol; ammonia; nickel; at 40 - 90 ℃; under 73550.8 Torr; Hydrogenation_.aus dem in geringer Menge erhaltenen Reaktionsprodukts (Kp_0.5: 260-270grad) und Phenylisocyanat;

upstream raw materials:

4-ethoxy-3-methoxybenzaldehyde

4-ethoxy-3-methoxybenzonitrile

C₁₅H₂₃NO₄

4-hydroxy-3-methoxybenzoic acid methyl ester

Downstream raw materials:

ethyl 2-[5-bromo-4-(4-ethoxy-3-methoxybenzylamino)-6-oxopyridazin-1(6H)-yl]acetate