ISOJASMONE

Base Information Edit

Chemical Name:ISOJASMONE
CAS No.:95-41-0
Molecular Formula:C11H18O
Molecular Weight:166.263
Hs Code.:2914299000
European Community (EC) Number:202-417-5
NSC Number:78462
UNII:VSY2Y3L5M0
DSSTox Substance ID:DTXSID3052640
Nikkaji Number:J55.445F
Wikidata:Q27292004
Mol file:95-41-0.mol

Synonyms:2-Hexyl-1-cyclopenten-3-one;2-Hexyl-2-cyclopenten-1-one;2-Hexyl-2-cyclopentenone;Isojasmol;NSC 78462;

Suppliers and Price of ISOJASMONE

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

American Custom Chemicals Corporation
ISOJASMONE 95.00%
5MG
$ 495.86

Total 27 raw suppliers

Chemical Property of ISOJASMONE Edit

Chemical Property:

Appearance/Colour:colorless to light yellow liquid
Vapor Pressure:0.016mmHg at 25°C
Refractive Index:1.474
Boiling Point:255.8 °C at 760 mmHg
Flash Point:107.7 °C
PSA：17.07000
Density:0.923 g/cm³
LogP:3.24610
Water Solubility.:252.21mg/L at 20℃
XLogP3:3.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:5
Exact Mass:166.135765193
Heavy Atom Count:12
Complexity:179

Purity/Quality:

99.9% ^*data from raw suppliers

ISOJASMONE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn
Hazard Codes:Xn
Statements: 22

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCCC1=CCCC1=O

Technology Process of ISOJASMONE

There total 36 articles about ISOJASMONE 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: 95.0%

: 74390-92-4
3-Chloro-2-hexyl-cyclopent-2-enone

: 95-41-0
2-(n-hexyl)-2-cyclopenten-1-one

Guidance literature:: With sulfuric acid; In methanol; electrolysis;

Reference yield: 89.0%

: 71525-51-4
4-Oxo-undecanal

: 95-41-0
2-(n-hexyl)-2-cyclopenten-1-one

Guidance literature:: With sodium hydroxide; In diethyl ether; for 72h; Ambient temperature;
DOI:10.1055/s-1989-27330

Reference yield: 81.0%

: 33948-35-5
2-iodo-cyclopent-2-enone

: 3761-92-0
n-hexylmagnesium bromide

: 95-41-0
2-(n-hexyl)-2-cyclopenten-1-one

Guidance literature:: n-hexylmagnesium bromide; With zinc dibromide; In tetrahydrofuran; diethyl ether; at -78 - 0 ℃;

2-iodo-cyclopent-2-enone; With bis-triphenylphosphine-palladium(II) chloride; In tetrahydrofuran; diethyl ether; N,N-dimethyl-formamide; at 23 ℃; for 2h;
DOI:10.1016/S0040-4020(00)00864-4