Methyl 2-nonynoate

Base Information

Chemical Name:Methyl 2-nonynoate
CAS No.:111-80-8
Molecular Formula:C10H16 O2
Molecular Weight:168.236
Hs Code.:29161900
European Community (EC) Number:203-909-2
NSC Number:72102
UNII:8RN66UR57V
DSSTox Substance ID:DTXSID3047639
Nikkaji Number:J34.596B
Wikidata:Q27122729
Metabolomics Workbench ID:44793
ChEMBL ID:CHEMBL3185173
Mol file:111-80-8.mol

Synonyms:2-nonynoic acid methyl ester;methyl 2-nonynoate;methyl octine carbonate

Suppliers and Price of Methyl 2-nonynoate

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

TCI Chemical
Methyl 2-Nonynoate >98.0%(GC)
25mL
$ 30.00

Sigma-Aldrich
Methyl 2-nonynoate 99%, FG
100 g
$ 117.00

Sigma-Aldrich
Methyl 2-nonynoate 99%, FG
100g-k
$ 117.00

Sigma-Aldrich
Methyl 2-nonynoate 99%, FG
1 kg
$ 517.00

Sigma-Aldrich
Methyl 2-nonynoate 99%, FG
1kg-k
$ 517.00

Sigma-Aldrich
Methyl 2-nonynoate 99%,FG
1 SAMPLE-K
$ 50.00

Sigma-Aldrich
Methyl 2-nonynoate 99%, FG
sample-k
$ 50.00

Crysdot
Methylnon-2-ynoate 95+%
500g
$ 314.00

Chem-Impex
Methyl2-nonynoate,≥99%,FG,KOSHER,FEMA2726 ≥99%
5G
$ 27.66

American Custom Chemicals Corporation
METHYL NON-2-YNOATE 95.00%
50G
$ 2498.27

Total 46 raw suppliers

Chemical Property of Methyl 2-nonynoate

Chemical Property:

Vapor Pressure:0.0568mmHg at 25°C
Refractive Index:n20/D 1.448(lit.)
Boiling Point:233.1°Cat760mmHg
Flash Point:100.6°C
PSA：26.30000
Density:0.932g/cm³
LogP:2.13320
Storage Temp.:2-8°C
XLogP3:3.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:168.115029749
Heavy Atom Count:12
Complexity:183

Purity/Quality:

99% ^*data from raw suppliers

Methyl 2-Nonynoate >98.0%(GC) ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi
Hazard Codes:Xn
Statements: 36/37/38-22-36/38
Safety Statements: 26-36/37/39-37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:CCCCCCC#CC(=O)OC
Description Methyl 2-nonynoate has a characteristic violet-like odor with a sweet taste reminiscent of fresh peach, unripe banana, and cucumber peel. May be prepared from 2-octene by way of 1-octyne and octyne carboxylic acid.

Technology Process of Methyl 2-nonynoate

There total 10 articles about Methyl 2-nonynoate 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: 98.0%

: 629-05-0
n-octyne

: 79-22-1
methyl chloroformate

: 111-80-8
methyl non-2-ynoate

Guidance literature:: n-octyne; With n-butyllithium; In tetrahydrofuran; hexane; at -78 ℃; for 1.33333h;

methyl chloroformate; In tetrahydrofuran; hexane; at -78 - 20 ℃;
DOI:10.1021/ja203171x