3,4-Dibenzyloxy aniline

Base Information

• Chemical Name: 3,4-Dibenzyloxy aniline
• CAS No.: 18002-44-3
• Molecular Formula: C20H19NO2
• Molecular Weight: 305.376
• ChEMBL ID: CHEMBL170337
• DSSTox Substance ID: DTXSID50482594
• Wikidata: Q82319079
• Mol file: 18002-44-3.mol

Synonyms:3,4-BIS(BENZYLOXY)ANILINE;18002-44-3;3,4-dibenzyloxy aniline;3,4-bis(phenylmethoxy)aniline;Benzenamine, 3,4-bis(phenylmethoxy)-;3,4-dibenzyloxyaniline;CHEMBL170337;SCHEMBL5659691;DTXSID50482594;PCAOYIXQKCKNNT-UHFFFAOYSA-N;SB83208;BS-21767

Chemical Property of 3,4-Dibenzyloxy aniline

Chemical Property:

• XLogP3: 4.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 305.141578849
• Heavy Atom Count: 23
• Complexity: 324

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)COC2=C(C=C(C=C2)N)OCC3=CC=CC=C3

Technology Process of 3,4-Dibenzyloxy aniline

There total 11 articles about 3,4-Dibenzyloxy aniline 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: 73.0%

1,2-bis(benzyloxy)-4-nitrobenzene (28387-13-5) → 3,4-Bis(phenylmethoxy)benzeneamine (18002-44-3)

Guidance literature:

With acetic acid; zinc; In dichloromethane; at 0 ℃; for 0.166667h; Inert atmosphere;

DOI:10.1016/j.bmc.2021.116039

Reference yield:

1,2-dihydroxy-4-nitrobenzene (3316-09-4) → 3,4-Bis(phenylmethoxy)benzeneamine (18002-44-3)

Guidance literature:

Multi-step reaction with 3 steps

1: NaH / dimethylformamide / Ambient temperature

2: NaH / dimethylformamide

3: H₂ / PtO₂ / ethyl acetate / Ambient temperature

With hydrogen; sodium hydride; platinum(IV) oxide; In ethyl acetate; N,N-dimethyl-formamide;

DOI:10.1016/S0960-894X(97)00124-8

Reference yield:

benzyl bromide (100-39-0) → 3,4-Bis(phenylmethoxy)benzeneamine (18002-44-3)

Guidance literature:

Multi-step reaction with 3 steps

1: NaH / dimethylformamide / Ambient temperature

2: NaH / dimethylformamide

3: H₂ / PtO₂ / ethyl acetate / Ambient temperature

With hydrogen; sodium hydride; platinum(IV) oxide; In ethyl acetate; N,N-dimethyl-formamide;

DOI:10.1016/S0960-894X(97)00124-8

upstream raw materials:

1,2-bis(benzyloxy)-4-nitrobenzene

1,2-dihydroxy-4-nitrobenzene

benzyl bromide

1,2-di(benzyloxy)benzene

Downstream raw materials:

acetic acid-(3,4-bis-benzyloxy-anilide)

2-chloro-N-[3,4-bis(phenylmethoxy)phenyl]acetamide

C₃₄H₃₆INO₆Si

2,3-bis(benzyloxy)-5-((2-(trimethylsilyl)ethoxy)methyl)-[1,3]dioxolo[4,5-j]phenanthridin-6(5H)-one

Refernces

• 1、 -. "SMALL MOLECULE COMPOUNDS TARGETING PBX1 TRANSCRIPTIONAL COMPLEX". Paragraph 0141. . Retrieved 2016/11/14.
• 2、 -. "SUBSTITUTED N-ARYL BENZAMIDES AND RELATED COMPOUNDS FOR TREATMENT OF AMYLOID DISEASES AND SYNUCLEINOPATHIES". Page/Page column 87-88. . Retrieved 2008/06/13.