2-Ethyl-6-hydroxybenzaldehyde

Base Information

• Chemical Name: 2-Ethyl-6-hydroxybenzaldehyde
• CAS No.: 138308-78-8
• Molecular Formula: C9H10O2
• Molecular Weight: 150.177
• Hs Code.: 2912499000
• DSSTox Substance ID: DTXSID80567348
• Wikidata: Q82453212
• Mol file: 138308-78-8.mol

Synonyms:2-ethyl-6-hydroxybenzaldehyde;138308-78-8;Benzaldehyde, 2-ethyl-6-hydroxy- (9CI);SCHEMBL1527075;DTXSID80567348;MB24050;A847089

Chemical Property of 2-Ethyl-6-hydroxybenzaldehyde

Chemical Property:

• PSA: 37.30000
• LogP: 1.76710
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 150.068079557
• Heavy Atom Count: 11
• Complexity: 134

Purity/Quality:

97% ^*data from raw suppliers

2-Ethyl-6-hydroxybenzaldehyde 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCC1=C(C(=CC=C1)O)C=O

Technology Process of 2-Ethyl-6-hydroxybenzaldehyde

There total 5 articles about 2-Ethyl-6-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: 100.0%

C11H14O3 (1146962-14-2) → 2-ethyl-6-hydroxybenzaldehyde (138308-78-8)

Guidance literature:

With water; toluene-4-sulfonic acid; In 1,4-dioxane; for 12h; Reflux;

Reference yield: 98.0%

potassium ethyltrifluoroboranuide + 2-chloro-6-hydroxybenzaldehyde (18362-30-6) → 2-ethyl-6-hydroxybenzaldehyde (138308-78-8)

Guidance literature:

With potassium carbonate; bis(dibenzylideneacetone)-palladium⁽⁰⁾; ruphos; In water; toluene; for 18h; Reflux; Inert atmosphere;

DOI:10.1021/acs.orglett.6b03219

Reference yield:

3-ethylphenol (620-17-7) → 2-ethyl-6-hydroxybenzaldehyde (138308-78-8)

Guidance literature:

With sodium hydroxide; chloroform;

upstream raw materials:

3-ethylphenol

chloroform

C₁₁H₁₄O₃

2-chloro-6-hydroxybenzaldehyde

Downstream raw materials:

C₁₁H₁₃NO₃

2-ethyl-6-methoxybenzoic acid

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