5-Methoxyvalerophenone

Base Information

• Chemical Name: 5-Methoxyvalerophenone
• CAS No.: 34008-70-3
• Molecular Formula: C12H16O2
• Molecular Weight: 192.258
• DSSTox Substance ID: DTXSID101306298
• Wikidata: Q27116972
• Metabolomics Workbench ID: 55495
• Mol file: 34008-70-3.mol

Synonyms:5-methoxyvalerophenone;5-methoxy-1-phenylpentan-1-one;5-methoxy-1-phenyl-1-pentanone;34008-70-3;CHEBI:36814;SCHEMBL6591360;GMRYZTZQKPZDLK-UHFFFAOYSA-N;DTXSID101306298;Q27116972

Chemical Property of 5-Methoxyvalerophenone

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 192.115029749
• Heavy Atom Count: 14
• Complexity: 160

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COCCCCC(=O)C1=CC=CC=C1

Technology Process of 5-Methoxyvalerophenone

There total 10 articles about 5-Methoxyvalerophenone 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:

phenylmagnesium bromide (100-58-3) → 5-methoxy-1-phenyl-pentan-1-one (34008-70-3)

Guidance literature:

With hydrogenchloride; In diethyl ether;

Reference yield:

(+/-)-5-Methoxy-1-phenyl-1-pentanol (1622-00-0) → 5-methoxy-1-phenyl-pentan-1-one (34008-70-3)

Guidance literature:

With chromium(VI) oxide; sulfuric acid;

DOI:10.1021/ja00833a022

Reference yield:

benzaldehyde (100-52-7) → 5-methoxy-1-phenyl-pentan-1-one (34008-70-3)

Guidance literature:

Multi-step reaction with 2 steps

2: CrO₃, H₂SO₄

With chromium(VI) oxide; sulfuric acid;

DOI:10.1021/ja00833a022

upstream raw materials:

methanol

5-Chloro-1-phenyl-1-pentanone

(+/-)-5-Methoxy-1-phenyl-1-pentanol

methoxypropanol

Downstream raw materials:

2-Chloro-5-methoxy-1-phenyl-pentan-1-one

(+/-)-5-Methoxy-1-phenyl-1-pentanol

Refernces

• 1、 -. "1-substituted, 3-carboxylic acid piperidine derivatives". . . Retrieved 2008/06/13.