1-(5-Hexyl-2-hydroxyphenyl)ethan-1-one

Base Information

• Chemical Name: 1-(5-Hexyl-2-hydroxyphenyl)ethan-1-one
• CAS No.: 55168-32-6
• Molecular Formula: C₁₄H₂₀O₂
• Molecular Weight: 220.312
• Hs Code.: 2912490090
• European Community (EC) Number: 806-890-4
• Mol file: 55168-32-6.mol

Synonyms:1-(5-hexyl-2-hydroxyphenyl)ethan-1-one;55168-32-6;1-(5-hexyl-2-hydroxyphenyl)ethanone;SCHEMBL15765290;AKOS025393559;SS-4680;CS-0453717

Chemical Property of 1-(5-Hexyl-2-hydroxyphenyl)ethan-1-one

Chemical Property:

• XLogP3: 4.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 220.146329876
• Heavy Atom Count: 16
• Complexity: 213

Purity/Quality:

99% ^*data from raw suppliers

1-(5-Hexyl-2-hydroxyphenyl)ethan-1-one ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCCCC1=CC(=C(C=C1)O)C(=O)C

Technology Process of 1-(5-Hexyl-2-hydroxyphenyl)ethan-1-one

There total 2 articles about 1-(5-Hexyl-2-hydroxyphenyl)ethan-1-one 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: 87.0%

p-n-Hexylphenylacetat (55168-28-0) → 5-n-hexyl-2-hydroxy-acetophenone (55168-32-6)

Guidance literature:

With aluminum (III) chloride;

Reference yield: 54.0%

1-methyl-1,3-bis(trimethylsilyloxy)buta-1,3-diene (63446-76-4,63446-77-5,68225-97-8) + 2-diethoxymethyl-1,1-diethoxyoctane (59855-08-2) → 5-n-hexyl-2-hydroxy-acetophenone (55168-32-6)

Guidance literature:

With titanium tetrachloride; In dichloromethane; at -78 - 20 ℃; for 14h;

DOI:10.1021/jo070847e

Reference yield: 58.0%

5-n-hexyl-2-hydroxy-acetophenone (55168-32-6) + trimethyleneglycol (504-63-2) → C17H26O3 (1612141-63-5)

Guidance literature:

With Triisopropoxymethan; cerium triflate;

upstream raw materials:

p-n-Hexylphenylacetat

1-methyl-1,3-bis(trimethylsilyloxy)buta-1,3-diene

2-diethoxymethyl-1,1-diethoxyoctane

Downstream raw materials:

(S)-4-hexyl-2-(2-methyl-1,3-dioxan-2-yl)-phenyl 2-methoxypropanoate

C₁₇H₂₆O₃

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