[2-(4-Methoxyphenyl)-1H-benzimidazol-6-yl]methanol

Base Information

• Chemical Name: [2-(4-Methoxyphenyl)-1H-benzimidazol-6-yl]methanol
• CAS No.: 126824-21-3
• Molecular Formula: C15H14N2O2
• Molecular Weight: 254.288
• DSSTox Substance ID: DTXSID70693428
• Nikkaji Number: J1.367.254G
• Wikidata: Q82622474
• ChEMBL ID: CHEMBL1672853
• Mol file: 126824-21-3.mol

Synonyms:126824-21-3;[2-(4-Methoxyphenyl)-1H-benzimidazol-6-yl]methanol;CHEMBL1672853;DTXSID70693428;2-(4-Methoxyphenyl)-1H-benzimidazole-6-methanol

Chemical Property of [2-(4-Methoxyphenyl)-1H-benzimidazol-6-yl]methanol

Chemical Property:

• XLogP3: 2.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 254.105527694
• Heavy Atom Count: 19
• Complexity: 292

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)CO

Technology Process of [2-(4-Methoxyphenyl)-1H-benzimidazol-6-yl]methanol

There total 11 articles about [2-(4-Methoxyphenyl)-1H-benzimidazol-6-yl]methanol 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: 91.0%

1,2-diamino-4-hydroxymethylbenzene (63189-98-0) + 4-methoxy-benzaldehyde (123-11-5) → 5-(Hydroxymethyl)-2-(4-methoxyphenyl)-1H-benzimidazole (126824-21-3)

Guidance literature:

1,2-diamino-4-hydroxymethylbenzene; 4-methoxy-benzaldehyde; In acetonitrile; at 90 ℃; for 1h;

With oxygen; iron(III) chloride; In acetonitrile; at 90 ℃;

DOI:10.1055/s-2000-7111

Reference yield: 71.0%

2-(4-methoxyphenyl)-1H-benzo[d]imidazole-6-carbaldehyde (126824-22-4) → 5-(Hydroxymethyl)-2-(4-methoxyphenyl)-1H-benzimidazole (126824-21-3)

Guidance literature:

With hydrogenchloride; methanol; sodium cyanoborohydride; for 3h;

DOI:10.1016/0968-0896(96)00047-8

Reference yield: 67.0%

2-(4-methoxy-phenyl)-1H-benzimidazole-6-carboxylic acid ethyl ester (126824-19-9) → 5-(Hydroxymethyl)-2-(4-methoxyphenyl)-1H-benzimidazole (126824-21-3)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; Heating;

DOI:10.1016/S0968-0896(01)00170-5

upstream raw materials:

methyl 2-(4-methoxyphenyl)-1H-benzo[d]imidazole-6-carboxylate

2-(4-methoxyphenyl)-1H-benzo[d]imidazole-6-carbaldehyde

1,2-diamino-4-hydroxymethylbenzene

4-methoxy-benzaldehyde

Downstream raw materials:

8-[2-(4-Methoxy-phenyl)-3H-benzoimidazol-5-yl]-2-(4-methyl-piperazin-1-yl)-9H-purine

{1-[2'-(4-methoxy-phenyl)-3H,3'H-[2,5']bibenzoimidazolyl-5-yl]-pyrrolidin-3-yl}-carbamic acid tert-butyl ester

2'-(4-methoxy-phenyl)-[2,6'] bis(1H-benzoimidazole)-6-carboxylic acid methoxy-methyl amide

2'-(4-methoxy-phenyl)-[2,6'] bis(1H-benzoimidazole)-6-carboxylic acid

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