3-(Benzyloxy)-4-hydroxybenzaldehyde

Base Information

• Chemical Name: 3-(Benzyloxy)-4-hydroxybenzaldehyde
• CAS No.: 50773-56-3
• Molecular Formula: C14H12O3
• Molecular Weight: 228.247
• Hs Code.: 2912490090
• DSSTox Substance ID: DTXSID10452197
• Nikkaji Number: J474.479I
• Wikidata: Q82272654
• Mol file: 50773-56-3.mol

Synonyms:3-(benzyloxy)-4-hydroxybenzaldehyde;50773-56-3;3-benzyloxy-4-hydroxybenzaldehyde;4-hydroxy-3-phenylmethoxybenzaldehyde;4-Hydroxy 3-(phenylmethoxy)benzaldehyde;Benzaldehyde, 4-hydroxy-3-(phenylmethoxy)-;SCHEMBL1031969;3-benzyloxy-4-hydroxybenzaldeyde;DTXSID10452197;3-bezyloxy-4-hydroxy benzaldehyde;CWMRCRFALIQFHU-UHFFFAOYSA-N;3-Benzyloxy-4-hydroxy benzaldehyde;AMY34778;MFCD09836534;AKOS005067842;SB40466;4-hydroxy-3-(phenylmethoxy)benzaldehyde;AS-52566;CS-0051717;P15351;EN300-1695579;A871459;Z2044824770

Chemical Property of 3-(Benzyloxy)-4-hydroxybenzaldehyde

Chemical Property:

• Melting Point: 113-114 °C
• Boiling Point: 399.7±27.0 °C(Predicted)
• PKA: 7.32±0.43(Predicted)
• PSA: 46.53000
• Density: 1.238±0.06 g/cm3(Predicted)
• LogP: 2.78370
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Solubility.: DMSO, Ethyl Acetate (Slightly)
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 228.078644241
• Heavy Atom Count: 17
• Complexity: 236

Purity/Quality:

97% ^*data from raw suppliers

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

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)COC2=C(C=CC(=C2)C=O)O
• Uses: 3-Benzyloxy-4-hydroxybenzaldehyde is a reactant used in the preparation of PDE4 and PDE7 inhibitors, insulin-like growth-factor-I receptor (IGF-IR) inhibitors and ferulic acid derivatives as xanthine oxidase inhibitors.

Technology Process of 3-(Benzyloxy)-4-hydroxybenzaldehyde

There total 23 articles about 3-(Benzyloxy)-4-hydroxybenzaldehyde 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: 92.0%

C15H15N3O3 → 3-benzyloxy-4-hydroxybenzaldehyde (50773-56-3)

Guidance literature:

With phosphoric acid; for 0.00555556h; microwave irradiation;

Reference yield: 84.3%

3-benzyloxy-4-methoxybenzaldehyde (6346-05-0) → 3-benzyloxy-4-hydroxybenzaldehyde (50773-56-3)

Guidance literature:

With sodium hydride; ethanethiol; In N,N-dimethyl-formamide; mineral oil; at 70 ℃; for 1.5h; Cooling with ice;

Reference yield: 82.0%

3-benzyloxy-4-(4-methoxybenzyloxy)benzaldehyde (402573-75-5) → 3-benzyloxy-4-hydroxybenzaldehyde (50773-56-3)

Guidance literature:

With water; acetic acid; at 150 ℃; for 48h; Heating / reflux;

upstream raw materials:

1-(3-benzyloxy-4-hydroxy-phenyl)-2,2,2-trichloro-ethanol

benzyl chloride

3,4-dihydroxybenzaldehyde

3-benzyloxy-4-methoxybenzaldehyde

Downstream raw materials:

3-benzyloxy-4-hydroxy-benzoic acid

Ethyl (+/-)-2-benzoyl-2-(2-benzyloxy-4-formylphenoxy)acetate

4-((3S,4S,5S)-5-Acetyl-3,4-bis-benzyloxy-tetrahydro-furan-2-yloxy)-3-benzyloxy-benzaldehyde

Methyl (+/-)-2-(3-methoxybenzoyl)-2-(2-benzyloxy-4-formylphenoxy)acetate