1-methyl-2-phenyl-1H-imidazole-4-carbaldehyde

Base Information

• Chemical Name: 1-methyl-2-phenyl-1H-imidazole-4-carbaldehyde
• CAS No.: 94938-02-0
• Molecular Formula: C11H10N2O
• Molecular Weight: 186.21000
• Hs Code.: 2933290090
• DSSTox Substance ID: DTXSID10444315
• Nikkaji Number: J2.177.393J
• Wikidata: Q82262428
• Mol file: 94938-02-0.mol

Synonyms:1-methyl-2-phenyl-1H-imidazole-4-carbaldehyde;94938-02-0;1-methyl-2-phenylimidazole-4-carbaldehyde;SCHEMBL1313133;DTXSID10444315;MFCD08703272;AKOS005766004;GE-0738;AM20041453;FT-0682004;J-504918

Chemical Property of 1-methyl-2-phenyl-1H-imidazole-4-carbaldehyde

Chemical Property:

• PSA: 34.89000
• LogP: 1.89960
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 186.079312947
• Heavy Atom Count: 14
• Complexity: 202

Purity/Quality:

97% ^*data from raw suppliers

1-Methyl-2-phenyl-1H-imidazole-4-carbaldehyde >95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C=C(N=C1C2=CC=CC=C2)C=O

Technology Process of 1-methyl-2-phenyl-1H-imidazole-4-carbaldehyde

There total 9 articles about 1-methyl-2-phenyl-1H-imidazole-4-carbaldehyde 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: 71.0%

(1-methyl-2-phenyl-1H-imidazol-4-yl)methanol (99280-78-1) → 1-methyl-2-phenyl-1H-imidazole-4-carboxaldehyde (94938-02-0)

Guidance literature:

With manganese(IV) oxide; In tetrahydrofuran; for 1.5h; Heating;

DOI:10.1021/jm00152a015

Reference yield: 63.0%

N-allyl-N-methyl-phenylamidine → 1-methyl-2-phenyl-1H-imidazole-4-carboxaldehyde (94938-02-0)

Guidance literature:

With potassium phosphate; oxygen; copper(II) bis(trifluoromethanesulfonate); In N,N-dimethyl acetamide; at 105 ℃; for 5h;

DOI:10.1002/anie.201100362

Reference yield: 44.0%

2-phenyl-1H-imidazole-4-carbaldehyde (68282-47-3) + methyl iodide (74-88-4) → 1-methyl-2-phenyl-1H-imidazole-4-carboxaldehyde (94938-02-0)

Guidance literature:

2-phenyl-1H-imidazole-4-carbaldehyde; With sodium hydride; In N,N-dimethyl-formamide; at 0 ℃;

methyl iodide; In N,N-dimethyl-formamide; at 0 ℃; for 3h;

DOI:10.1021/ja047437h

upstream raw materials:

(1-methyl-2-phenyl-1H-imidazol-4-yl)methanol

dimethyl sulfate

2-phenyl-1H-imidazole-4-carbaldehyde

methyl iodide

Downstream raw materials:

bis[(1-methyl-2-phenyl-4-imidazolyl)methyl]benzylamine

bis[(1-methyl-2-phenyl-4-imidazolyl)methyl]amine