4-Benzyloxy-3-methoxybenzaldehyde

Base Information

• Chemical Name: 4-Benzyloxy-3-methoxybenzaldehyde
• CAS No.: 2426-87-1
• Molecular Formula: C15H14O3
• Molecular Weight: 242.274
• Hs Code.: 29125000
• European Community (EC) Number: 219-379-0
• NSC Number: 208757,44876,22599
• UNII: 5KNC2TSW9G
• DSSTox Substance ID: DTXSID80178958
• Nikkaji Number: J216.072B
• Wikidata: Q27262489
• ChEMBL ID: CHEMBL3278089
• Mol file: 2426-87-1.mol

Synonyms:4-benzyloxy-3-methoxybenzaldehyde;benzylvanillin;vanillin benzyl ether;vanillyl benzyl ether

Chemical Property of 4-Benzyloxy-3-methoxybenzaldehyde

Chemical Property:

• Appearance/Colour: Yellow crystalline powder or crystalline chunks
• Vapor Pressure: 2.17E-06mmHg at 25°C
• Melting Point: 62-64 °C(lit.)
• Refractive Index: 1.59
• Boiling Point: 393.1 °C at 760 mmHg
• Flash Point: 183.1 °C
• PSA: 35.53000
• Density: 1.154 g/cm³
• LogP: 3.08670
• Storage Temp.: Refrigerator, Under Inert Atmosphere
• Sensitive.: Air Sensitive
• Solubility.: Soluble in chloroform, methanol.
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 242.094294304
• Heavy Atom Count: 18
• Complexity: 248

Purity/Quality:

97% ^*data from raw suppliers

4-Benzyloxy-3-methoxybenzaldehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 22-24/25-37-26

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: Other Classes -> Benzaldehydes
• Canonical SMILES: COC1=C(C=CC(=C1)C=O)OCC2=CC=CC=C2
• Uses: 4-Benzyloxy-3-methoxybenzaldehyde was used in the synthesis of 1,2-bis(4-benzyloxy-3-methoxyphenyl)-3-hydroxy-propionic acid1. It was also used in first enantioselective total synthesis of a neurotrophic (-)-talaumidin. 4-Benzyloxy-3-methoxybenzaldehyde reacts with benzohydrazide to yield (E)-N?-(4-benzyloxy-3-methoxybenzylidene)benzohydrazide.

Technology Process of 4-Benzyloxy-3-methoxybenzaldehyde

There total 37 articles about 4-Benzyloxy-3-methoxybenzaldehyde 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%

sodium; (4-benzyloxy-3-methoxy-phenyl)-hydroxy-methanesulfonate → 3-methoxy-4-(phenylmethoxy)benzaldehyde (2426-87-1)

Guidance literature:

With Montmorillonite KSF clay; for 0.00277778h; microwave irradiation;

DOI:10.1039/a900309f

Reference yield: 92.0%

4-Benzyloxy-3-methoxybenzaldehyde semicarbazone (81263-72-1) → 3-methoxy-4-(phenylmethoxy)benzaldehyde (2426-87-1)

Guidance literature:

With (Bu₄N)₂S₂O₈; In 1,2-dichloro-ethane; at 80 ℃; for 0.5h;

DOI:10.1080/00397910008086869

Reference yield: 92.0%

1,1-diacetoxy-1-[4-(benzyloxy)-3-methoxyphenyl]methane → 3-methoxy-4-(phenylmethoxy)benzaldehyde (2426-87-1)

Guidance literature:

With zirconium(IV) chloride; In methanol; at 20 ℃; for 0.166667h;

DOI:10.1016/j.tet.2003.10.002

upstream raw materials:

(E)-2-methoxy-1-(phenylmethoxy)-4-(prop-1-en-1-yl)benzene

benzyl chloride

vanillin

4-benzyloxy-3-hydroxy-benzaldehyde

Downstream raw materials:

1-(4-benzyloxy-3-methoxyphenyl)-2-propanone

4-(4-benzyloxy-3-methoxy-benzylidene)-2-phenyl-4H-oxazol-5-one

5-(4-benzyloxy-3-methoxy-benzylidene)-2-thioxo-thiazolidin-4-one

3-[(3'-Methoxy-4'-benzyloxyphenyl)hydroxymethyl]-pyridine