3-Nonyn-5-one, 9-hydroxy-1-(phenylmethoxy)-

Base Information

Chemical Name:3-Nonyn-5-one, 9-hydroxy-1-(phenylmethoxy)-
CAS No.:616240-05-2
Molecular Formula:C16H20O3
Molecular Weight:260.333
Hs Code.:
DSSTox Substance ID:DTXSID80476764
Nikkaji Number:J2.141.797A
Wikidata:Q82308558

Synonyms:3-Nonyn-5-one, 9-hydroxy-1-(phenylmethoxy)-;616240-05-2;DTXSID80476764

Suppliers and Price of 3-Nonyn-5-one, 9-hydroxy-1-(phenylmethoxy)-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
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price

Total 1 raw suppliers

Chemical Property of 3-Nonyn-5-one, 9-hydroxy-1-(phenylmethoxy)-

Chemical Property:

PSA：46.53000
LogP:2.32840
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:8
Exact Mass:260.14124450
Heavy Atom Count:19
Complexity:304

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)COCCC#CC(=O)CCCCO

Technology Process of 3-Nonyn-5-one, 9-hydroxy-1-(phenylmethoxy)-

There total 2 articles about 3-Nonyn-5-one, 9-hydroxy-1-(phenylmethoxy)- 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%

: 542-28-9,26354-94-9
3,4,5,6-tetrahydro-2H-pyran-2-one

: 22273-77-4
((but-3-yn-1-yloxy)methyl)benzene

: 616240-05-2
1-benzyloxy-9-hydroxy-non-3-yn-5-one

Guidance literature:: ((but-3-yn-1-yloxy)methyl)benzene; With n-butyllithium; In tetrahydrofuran; at -78 ℃; for 0.333333h;

With boron trifluoride diethyl etherate; In tetrahydrofuran; at -78 ℃; for 0.166667h;

3,4,5,6-tetrahydro-2H-pyran-2-one; In tetrahydrofuran; at -78 - 20 ℃; for 1h;

Reference yield:

: 100-39-0
benzyl bromide

: 616240-05-2
1-benzyloxy-9-hydroxy-non-3-yn-5-one

Guidance literature:: Multi-step reaction with 2 steps

1.1: 97 percent / NaH

2.1: BuLi / tetrahydrofuran / -78 °C

2.2: 87 percent / tetrahydrofuran / -78 °C

With n-butyllithium; sodium hydride; In tetrahydrofuran;
DOI:10.1071/CH04021