3-Nonanon-1-yl acetate

Base Information

Chemical Name:3-Nonanon-1-yl acetate
CAS No.:7779-54-6
Molecular Formula:C11H20O3
Molecular Weight:200.278
Hs Code.:
UNII:9ZU9P477VD
DSSTox Substance ID:DTXSID00228404
Metabolomics Workbench ID:47668
Nikkaji Number:J1.536.539K
Wikidata:Q83108395
Mol file:7779-54-6.mol

Synonyms:3-Nonanon-1-yl acetate;3-OXONONYL ACETATE;7779-54-6;1-(Acetyloxy)-3-nonanone;3-Oxononanyl acetate;3-Nonanone, 1-(acetyloxy)-;3-Nonanone, 1-hydroxy-, acetate;1-Hydroxy-3-nonanone acetate;3-Nonanone, 1-hydroxy, acetate;Methylol methyl hexyl ketone acetate;1-Acetoxy-3-nonanone;9ZU9P477VD;SCHEMBL26632730;DTXSID00228404;CHEBI:174008;NS00128887

Suppliers and Price of 3-Nonanon-1-yl acetate

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
Packaging
price

Total 4 raw suppliers

Chemical Property of 3-Nonanon-1-yl acetate

Chemical Property:

Vapor Pressure:0.00383mmHg at 25°C
Boiling Point:280.2°C at 760 mmHg
Flash Point:117.6°C
PSA：43.37000
Density:0.95g/cm³
LogP:2.47910
XLogP3:2.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:9
Exact Mass:200.14124450
Heavy Atom Count:14
Complexity:175

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCCC(=O)CCOC(=O)C
Description 3-Nonanon-l-yl acetate has a herbaceous, fruity odor. Prepared by condensation of methyl hexyl ketone with formaldehyde under mild alkaline conditions to yield (β-ketol, which is subsequently acetylated.

Technology Process of 3-Nonanon-1-yl acetate

There total 7 articles about 3-Nonanon-1-yl acetate 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: 80.0%

: 24415-26-7
non-1-en-3-one

: 64-19-7,77671-22-8
acetic acid

: 7779-54-6
1-acetoxy-3-nonanone

Guidance literature:: With sulfuric acid; at 20 ℃; for 5h;
DOI:10.1007/BF00952226

Reference yield:

: 41453-57-0
(Z)-non-2-en-1-yl acetate

: 7779-54-6
1-acetoxy-3-nonanone

Guidance literature:: With N,N-dimethyl acetamide; water; oxygen; palladium dichloride; at 80 ℃; for 10h; under 4560.31 Torr;
DOI:10.1016/j.tetlet.2013.01.049

Reference yield:

: 13049-88-2
cis-non-3-en-1-yl acetate

: 7779-54-6
1-acetoxy-3-nonanone

: 1426147-68-3
1-Acetoxy-4-nonanone

Guidance literature:: With N,N-dimethyl acetamide; water; oxygen; palladium dichloride; at 80 ℃; for 10h; under 4560.31 Torr; Overall yield = 79 %Chromat.;
DOI:10.1016/j.tetlet.2013.01.049