Isochromophilone VI

Base Information

Chemical Name:Isochromophilone VI
CAS No.:167173-91-3
Molecular Formula:C₂₃H₂₈ClNO₅
Molecular Weight:433.932
Hs Code.:
European Community (EC) Number:803-271-0
DSSTox Substance ID:DTXSID801347091
Wikidata:Q76386912
Metabolomics Workbench ID:99270
ChEMBL ID:CHEMBL5072126
Mol file:167173-91-3.mol

Synonyms:isochromophilone VI

Suppliers and Price of Isochromophilone VI

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

Sigma-Aldrich
Isochromophilone VI ≥90% (LC/MS-ELSD)
1mg
$ 578.00

Total 1 raw suppliers

Chemical Property of Isochromophilone VI

Chemical Property:

Vapor Pressure:4.45E-14mmHg at 25°C
Boiling Point:543.5°Cat760mmHg
Flash Point:282.5°C
PSA：85.60000
Density:1.24g/cm³
LogP:3.20130
Storage Temp.:?20°C
XLogP3:4.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:433.1656007
Heavy Atom Count:30
Complexity:909

Purity/Quality:: Isochromophilone VI ≥90% (LC/MS-ELSD) ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:T
Statements: 25
Safety Statements: 45

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC(C)C=C(C)C=CC1=CC2=C(C(=O)C(C(=O)C2=CN1CCO)(C)OC(=O)C)Cl
Isomeric SMILES:CC[C@H](C)/C=C(\C)/C=C/C1=CC2=C(C(=O)[C@](C(=O)C2=CN1CCO)(C)OC(=O)C)Cl

Technology Process of Isochromophilone VI

There total 2 articles about Isochromophilone VI 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: 88.0%