1-Phenyl-5-methyl-1-hexanone

Base Information

• Chemical Name: 1-Phenyl-5-methyl-1-hexanone
• CAS No.: 25552-17-4
• Molecular Formula: C13H18O
• Molecular Weight: 190.285
• Hs Code.: 2914399090
• Mol file: 25552-17-4.mol

Synonyms:5-methyl-1-phenylhexanone;5-methyl-1-phenyl-1-hexanone;isoheptanophenone;5-methyl-1-phenyl-hexan-1-one;5-methyl-1-phenylhexan-1-one;5-Methyl-1-phenyl-hexan-1-on;

Chemical Property of 1-Phenyl-5-methyl-1-hexanone

Chemical Property:

• Boiling Point: 148-151 °C(Press: 17 Torr)
• PSA: 17.07000
• Density: 0.933±0.06 g/cm3(Predicted)
• LogP: 3.69560

Purity/Quality:

5-methyl-1-phenylhexan-1-one ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 1-Phenyl-5-methyl-1-hexanone

There total 30 articles about 1-Phenyl-5-methyl-1-hexanone 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: 95.0%

i-Amyl alcohol (123-51-3) + 1-Phenylethanol (98-85-1,13323-81-4) → 5-methyl-1-phenylhexanone (25552-17-4)

Guidance literature:

With C₄₂H₃₆ClIrO₂P₂; potassium hydroxide; In para-xylene; at 130 ℃; for 12h; Reagent/catalyst; Inert atmosphere; Schlenk technique; Molecular sieve;

DOI:10.1002/adsc.201300656

Reference yield: 80.0%

i-Amyl alcohol (123-51-3) + acetophenone (98-86-2) → 5-methyl-1-phenylhexanone (25552-17-4)

Guidance literature:

With potassium hydroxide; 1-dodecene; tris(triphenylphosphine)ruthenium(II) chloride; In 1,4-dioxane; at 80 ℃; for 20h;

DOI:10.1016/S0040-4039(02)01625-8

Reference yield: 80.0%

Isopropenyl acetate (108-22-5) + 5-methyl-1-phenyl-hexan-1-ol (37563-31-8) → 5-methyl-1-phenylhexanone (25552-17-4) + C15H22O2 (1393380-73-8)

Guidance literature:

With dicarbonyl(chloro)(η⁵-pentaphenylcyclopentadienyl)ruthenium(II); potassium tert-butylate; sodium carbonate; In di-isopropyl ether; at 30 ℃; for 145h; optical yield given as %ee; enantioselective reaction; Inert atmosphere; Molecular sieve; Enzymatic reaction;

DOI:10.1039/c2ob25614b

upstream raw materials:

[1-(3-methylbutoxy)ethenyl]benzene

5-methylhexanoyl chloride

benzene

5-methyl-1-phenyl-hexan-1-ol

Downstream raw materials:

5-Methyl-2-(4-methyl-benzyl)-1-phenyl-hexan-1-one

5,6-dihydro-4-hydroxy-6-(4-methylpentyl)-6-phenyl-2H-pyran-2-one

2-Benzyl-5-methyl-1-phenyl-hexan-1-on

(5-methyl-hexyl)-benzene

Refernces

• 1、 Zhao, Chao-Yang,Ji, Ding-Wei,Zheng, Hao,He, Gu-Cheng,Liu, Heng,Hu, Yan-Cheng,Chen, Qing-An. "Pd-Catalyzed Redox Divergent Coupling of Ketones with Terpenols". . p. 6825 - 6834. Retrieved 2021/06/28.
• 2、 Wang, Jie,Pang, Yu-Bo,Tao, Na,Zeng, Run-Sheng,Zhao, Yingsheng. "Mn-Enabled Radical-Based Alkyl-Alkyl Cross-Coupling Reaction from 4-Alkyl-1,4-dihydropyridines". . p. 15315 - 15322. Retrieved 2019/11/19.