(1,2-Dimethyl-1H-benzo[d]imidazol-5-yl)methanol

Base Information

• Chemical Name: (1,2-Dimethyl-1H-benzo[d]imidazol-5-yl)methanol
• CAS No.: 4589-66-6
• Molecular Formula: C10H12N2O
• Molecular Weight: 176.21500
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID50388188
• Wikidata: Q82182963
• ChEMBL ID: CHEMBL1504267
• Mol file: 4589-66-6.mol

Synonyms:(1,2-Dimethyl-1H-benzo[d]imidazol-5-yl)methanol;4589-66-6;(1,2-dimethylbenzimidazol-5-yl)methanol;(1,2-dimethyl-1H-1,3-benzodiazol-5-yl)methanol;1H-Benzimidazole-5-methanol,1,2-dimethyl-(9CI);MLS000097838;SCHEMBL553989;CHEMBL1504267;DTXSID50388188;DTWCONPNVHZPJS-UHFFFAOYSA-N;REGID_for_CID_2998315;HMS2315H12;AMY13945;MFCD02690737;AKOS016012834;DS-5325;SMR000059946;CS-0152752;C75234;A872320;Z56758932

Chemical Property of (1,2-Dimethyl-1H-benzo[d]imidazol-5-yl)methanol

Chemical Property:

• PSA: 38.05000
• LogP: 1.37400
• Storage Temp.: 2-8°C
• XLogP3: 1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 176.094963011
• Heavy Atom Count: 13
• Complexity: 186

Purity/Quality:

98% ^*data from raw suppliers

(1,2-Dimethyl-1H-benzo[d]imidazol-5-yl)methanol 98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC2=C(N1C)C=CC(=C2)CO

Technology Process of (1,2-Dimethyl-1H-benzo[d]imidazol-5-yl)methanol

There total 2 articles about (1,2-Dimethyl-1H-benzo[d]imidazol-5-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:

1,2-dimethyl-1H-benzo[d]imidazole-5-carboxylic acid methyl ester (256936-11-5) → (1,2-dimethyl-1H-benzo[d]imidazol-5-yl)methanol (4589-66-6)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at 20 ℃; for 2h; Inert atmosphere;

DOI:10.1021/ol800089x

Reference yield:

→ (1,2-dimethyl-1H-benzo[d]imidazol-5-yl)methanol (4589-66-6)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; for 1h; Cooling with ice; Inert atmosphere;

Reference yield: 91.0%

(1,2-dimethyl-1H-benzo[d]imidazol-5-yl)methanol (4589-66-6) → 1,2-dimethyl-1H-benzo[d]imidazole-5-carbaldehyde (4597-21-1)

Guidance literature:

(1,2-dimethyl-1H-benzo[d]imidazol-5-yl)methanol; With oxalyl dichloride; dimethyl sulfoxide; In dichloromethane; at -78 ℃; for 2.5h;

With triethylamine; In dichloromethane; at -78 - -10 ℃;

DOI:10.1021/ol800089x

upstream raw materials:

1,2-dimethyl-1H-benzo[d]imidazole-5-carboxylic acid methyl ester

Downstream raw materials:

1,2-dimethyl-1H-benzo[d]imidazole-5-carbaldehyde

1,2-dimethyl-1H-benzo[d]imidazole-5-carboxylic acid methyl ester

Refernces

• 1、 -. "N-((6-AMINO-PYRIDIN-3-YL)METHYL)-HETEROARYL-CARBOXAMIDES". Page/Page column 82. . Retrieved 2012/02/15.