Allyl heptanoate

Base Information Edit

Chemical Name:Allyl heptanoate
CAS No.:142-19-8
Molecular Formula:C10H18O2
Molecular Weight:170.252
Hs Code.:29159000
European Community (EC) Number:205-527-1
NSC Number:20969
UNII:AU4CYG9V68
DSSTox Substance ID:DTXSID3044754
Nikkaji Number:J36.956J
Wikidata:Q10286055
RXCUI:2383533
Metabolomics Workbench ID:48906
ChEMBL ID:CHEMBL2268885
Mol file:142-19-8.mol

Synonyms:Allyl heptanoate;142-19-8;Allyl heptylate;2-Propenyl heptanoate;Allyl enanthate;Allyl heptoate;Heptanoic acid, 2-propenyl ester;Prop-2-en-1-yl heptanoate;prop-2-enyl heptanoate;HEPTANOIC ACID, ALLYL ESTER;Allylester kyseliny enanthove;Heptanoic acid, 2-propen-1-yl ester;FEMA No. 2031;Allyl heptanoate (natural);Heptanoic Acid Allyl Ester;Allyl n-heptanoate;NSC 20969;EINECS 205-527-1;Allylester kyseliny enanthove [Czech];UNII-AU4CYG9V68;AU4CYG9V68;AI3-36009;DTXSID3044754;NSC-20969;EC 205-527-1;allylheptanoate;allyl oenanthate;MFCD00038341;ALLYL HEPATONATE;SCHEMBL20820;WLN: 6VO2U1;ALLYL HEPTANOATE [FCC];ALLYL HEPTANOATE [FHFI];CHEMBL2268885;DTXCID1024754;CHEBI:180216;NSC20969;Tox21_301779;LMFA07010746;AKOS015907954;Allyl heptanoate, natural, 98%, FG;Allyl heptanoate, >=97%, FCC, FG;CS-W017692;HY-W016976;LS-2549;NCGC00256018-01;BS-42270;CAS-142-19-8;FT-0622002;A23480;A50640;Q10286055

Suppliers and Price of Allyl heptanoate

Supply Marketing:Edit

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

TRC
Allyl heptanoate
250mg
$ 45.00

TCI Chemical
Allyl Heptanoate >98.0%(GC)
250g
$ 561.00

TCI Chemical
Allyl Heptanoate >98.0%(GC)
25g
$ 89.00

Sigma-Aldrich
Allyl heptanoate ≥97%, FCC, FG
4 kg
$ 138.00

Sigma-Aldrich
Allyl heptanoate ≥97%, FCC, FG
4kg-k
$ 134.00

Sigma-Aldrich
Allyl heptanoate natural,98%,FG
1 SAMPLE-K
$ 50.00

Sigma-Aldrich
Allyl heptanoate natural, 98%, FG
sample-k
$ 50.00

Sigma-Aldrich
Allyl heptanoate ≥97%, FCC, FG
sample-k
$ 50.00

Sigma-Aldrich
Allyl heptanoate natural, 98%, FG
100 g
$ 72.20

Sigma-Aldrich
Allyl heptanoate natural, 98%, FG
100g-k
$ 70.00

Total 128 raw suppliers

Chemical Property of Allyl heptanoate Edit

Chemical Property:

Appearance/Colour:clear colourless liquid
Vapor Pressure:0.16mmHg at 25°C
Melting Point:-66 °C
Refractive Index:n20/D 1.428(lit.)
Boiling Point:214 °C at 760 mmHg
Flash Point:82.2 °C
PSA：26.30000
Density:0.885 g/cm³
LogP:2.68600
Storage Temp.:under inert gas (nitrogen or Argon) at 2-8°C
Solubility.:soluble in Methanol
Water Solubility.:INSOLUBLE
XLogP3:3.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:8
Exact Mass:170.130679813
Heavy Atom Count:12
Complexity:130

Purity/Quality:

99% ^*data from raw suppliers

Allyl heptanoate ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn
Hazard Codes:Xn
Statements: 21/22-20/21/22
Safety Statements: 36/37

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:CCCCCCC(=O)OCC=C
Uses Allyl heptanoate was one of the first to be Flavor and Extract Manufacturers Association-registered GRAS (generally recognized as safe). It can be used as part of ester complexes, primarily in fruit flavors like apple, pineapple, pear, plum, banana, fruit punch, and tropicals such as kiwi, papaya and mango. It can also play an important role in the fruity notes of aged cheeses, especially Parmesan, Asiago and grana padano.

Technology Process of Allyl heptanoate

There total 3 articles about Allyl heptanoate 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: 90.0%