4-Methoxy-2,6-dimethylbenzaldehyde

Base Information

• Chemical Name: 4-Methoxy-2,6-dimethylbenzaldehyde
• CAS No.: 19447-00-8
• Molecular Formula: C10H12 O2
• Molecular Weight: 164.204
• Hs Code.: 2912499000
• DSSTox Substance ID: DTXSID40355703
• Nikkaji Number: J328.259G
• Wikidata: Q82134740
• Mol file: 19447-00-8.mol

Synonyms:4-methoxy-2,6-dimethylbenzaldehyde;19447-00-8;2,6-DIMETHYL-4-METHOXYBENZALDEHYDE;Benzaldehyde, 4-methoxy-2,6-dimethyl-;SCHEMBL6268566;DTXSID40355703;ZFINNXSRPCWLHX-UHFFFAOYSA-N;4-methoxy-2,6-dimethylbenzaldehyd;4-methoxy-2.6-dimethylbenzaldehyd;2,6-dimethyl-4-methoxy-benzaldehyde;4-methoxy-2,6-dimethyl-benzaldehyde;CL9015;AKOS006294422;AM83132;DK-0722;BB 0262572;CS-0153489;FT-0692521;EN300-7374789;A852054;AB-131/40231429;Z1198165095

Chemical Property of 4-Methoxy-2,6-dimethylbenzaldehyde

Chemical Property:

• PSA: 26.30000
• LogP: 2.12450
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 164.083729621
• Heavy Atom Count: 12
• Complexity: 144

Purity/Quality:

97% ^*data from raw suppliers

4-Methoxy-2,6-dimethylbenzaldehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=CC(=C1C=O)C)OC

Technology Process of 4-Methoxy-2,6-dimethylbenzaldehyde

There total 16 articles about 4-Methoxy-2,6-dimethylbenzaldehyde 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: 100.0%

2,6-dimethyl-4-hydroxybenzaldehyde (70547-87-4) + dimethyl sulfate (77-78-1) → 4-methoxy-2,6-dimethylbenzylaldehyde (19447-00-8)

Guidance literature:

With potassium carbonate; In acetonitrile; at 25 ℃; for 16h;

DOI:10.1021/ol302550p DOI:10.1021/ol302550p

Reference yield: 62.0%

2-bromo-5-methoxy-1,3-dimethyl-benzene (6267-34-1) → 4-methoxy-2,6-dimethylbenzylaldehyde (19447-00-8)

Guidance literature:

2-bromo-5-methoxy-1,3-dimethyl-benzene; With tert.-butyl lithium; In tetrahydrofuran; DMF (N,N-dimethyl-formamide); pentane; at -78 - 20 ℃; for 3h;

With hydrogenchloride; In diethyl ether; water;

Reference yield: 61.0%

3,5-dimethylmethoxybenzene (874-63-5) + dicyanozinc (557-21-1) → 2-methoxy-4,6-dimethoxybenzyl alcohol (51926-66-0) + 4-methoxy-2,6-dimethylbenzylaldehyde (19447-00-8)

Guidance literature:

3,5-dimethylmethoxybenzene; dicyanozinc; With hydrogenchloride; In 1,1,2,2-tetrachloroethane; at 17 ℃; for 1h;

With aluminium trichloride; In 1,1,2,2-tetrachloroethane; at 55 ℃; for 3h;

DOI:10.1021/jm020536q

upstream raw materials:

hydrogen cyanide

3,5-dimethylmethoxybenzene

N,N-dimethyl-formamide

2,6-dimethyl-4-hydroxybenzaldehyde

Downstream raw materials:

3,5-dimethyl-4-(trans-2-nitro-vinyl)-anisole

3,4,5-Trimethylanisole

5-methoxy-1,3-dimethyl-2-nitrobenzene

2,6-Dimethyl-4-methoxybenzoic acid