2-(3,4,5-trimethoxyphenyl)-1H-benzimidazole

Base Information

• Chemical Name: 2-(3,4,5-trimethoxyphenyl)-1H-benzimidazole
• CAS No.: 175714-45-1
• Molecular Formula: C16H16N2O3
• Molecular Weight: 284.315
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID20353843
• Nikkaji Number: J2.554.881G
• Wikidata: Q82131656
• Mol file: 175714-45-1.mol

Synonyms:2-(3,4,5-trimethoxyphenyl)-1H-benzimidazole;175714-45-1;2-(3,4,5-trimethoxyphenyl)-1H-benzo[d]imidazole;2-(3,4,5-trimethoxyphenyl)-1H-1,3-benzodiazole;Oprea1_114258;F1216-0100;SCHEMBL7917574;1H-BENZIMIDAZOLE, 2-(3,4,5-TRIMETHOXYPHENYL)-;DTXSID20353843;FBZJKGVFZOUCRC-UHFFFAOYSA-N;HMS1616A07;CCG-23749;MFCD01159102;STL257224;AKOS000275518;BB 0219534;EU-0082558;EN300-36567;J-011127;Z50129863

Chemical Property of 2-(3,4,5-trimethoxyphenyl)-1H-benzimidazole

Chemical Property:

• PSA: 56.37000
• LogP: 3.25570
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 284.11609238
• Heavy Atom Count: 21
• Complexity: 328

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC(=CC(=C1OC)OC)C2=NC3=CC=CC=C3N2

Technology Process of 2-(3,4,5-trimethoxyphenyl)-1H-benzimidazole

There total 19 articles about 2-(3,4,5-trimethoxyphenyl)-1H-benzimidazole 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: 98.0%

3,4,5-trimethoxy-benzaldehyde (86-81-7) + 1,2-diamino-benzene (95-54-5) → 2-(3,4,5-trimethoxyphenyl)-1H-benzo[d]imidazole (175714-45-1)

Guidance literature:

In water; at 100 ℃; for 2.5h;

DOI:10.1080/00397911003642682

Reference yield: 92.0%

(1H?1,2,3?benzotriazol?1?yl)(3,4,5?trimethoxyphenyl)methanone (57710-78-8) + 1,2-diamino-benzene (95-54-5) → 2-(3,4,5-trimethoxyphenyl)-1H-benzo[d]imidazole (175714-45-1)

Guidance literature:

In water; for 1h; Microwave irradiation; Heating; Green chemistry;

DOI:10.3390/molecules25112501

Reference yield: 91.0%

(3,4,5-trimethoxyphenyl)methanol (3840-31-1) + 1,2-diamino-benzene (95-54-5) → 2-(3,4,5-trimethoxyphenyl)-1H-benzo[d]imidazole (175714-45-1)

Guidance literature:

With [2,2]bipyridinyl; 2,2,6,6-Tetramethyl-1-piperidinyloxy free radical; copper(l) chloride; In neat (no solvent); at 20 ℃; for 13h; Green chemistry;

DOI:10.1002/aoc.3039

upstream raw materials:

3,4,5-trimethoxy-benzaldehyde

1,2-diamino-benzene

(Z)-β-(3,4,5-trimethoxyphenyl) α-cyano propenoic acid

o-phenylenediamine dihydrochloride

Downstream raw materials:

C₃₀H₂₄N₂O₃