3-[(3E,7E,11E,15E)-18-(3,3-dimethyloxiran-2-yl)-3,7,12,16-tetramethyloctadeca-3,7,11,15-tetraenyl]-2,2-dimethyloxirane

Base Information

Chemical Name:3-[(3E,7E,11E,15E)-18-(3,3-dimethyloxiran-2-yl)-3,7,12,16-tetramethyloctadeca-3,7,11,15-tetraenyl]-2,2-dimethyloxirane
CAS No.:31063-19-1
Deprecated CAS:14031-39-1,14031-18-6,26955-87-3
Molecular Formula:C₃₀H₅₀O₂
Molecular Weight:442.726
Hs Code.:
Nikkaji Number:J375.032I,J1.452.574B
ChEMBL ID:CHEMBL21409
Mol file:31063-19-1.mol

Synonyms:2,3,22,23-dioxidosqualene;squalene 2,3,22,23-dioxide;squalene-2,3-22,23-dioxide

Suppliers and Price of 3-[(3E,7E,11E,15E)-18-(3,3-dimethyloxiran-2-yl)-3,7,12,16-tetramethyloctadeca-3,7,11,15-tetraenyl]-2,2-dimethyloxirane

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

TRC
Squalene2,3:22,23-Dioxide
250mg
$ 1210.00

Medical Isotopes, Inc.
Squalene2,3:22,23-Dioxide
100 mg
$ 625.00

Total 3 raw suppliers

Chemical Property of 3-[(3E,7E,11E,15E)-18-(3,3-dimethyloxiran-2-yl)-3,7,12,16-tetramethyloctadeca-3,7,11,15-tetraenyl]-2,2-dimethyloxirane

Chemical Property:

Boiling Point:513°Cat760mmHg
Flash Point:299.9°C
PSA：25.06000
Density:0.917g/cm³
LogP:9.02740
Storage Temp.:Amber Vial, -20°C Freezer
Solubility.:Chloroform (Slightly), Ethyl Acetate (Slightly)
XLogP3:9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:15
Exact Mass:442.381080833
Heavy Atom Count:32
Complexity:655

Purity/Quality:

98% ^*data from raw suppliers

Squalene2,3:22,23-Dioxide ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=CCCC=C(C)CCC=C(C)CCC1C(O1)(C)C)CCC=C(C)CCC2C(O2)(C)C
Isomeric SMILES:C/C(=C\CC/C=C(/CC/C=C(/CCC1OC1(C)C)\C)\C)/CC/C=C(/CCC2OC2(C)C)\C
Uses Squalene 2,3:22,23-Dioxide is formed from the epoxidation of 2,3-oxidosqualene, by squalene epoxidase. Squalene 2,3:22,23-Dioxide is accumulated intracellularly during the inhibition of cholesterol biosynthesis in Chinese hamster ovary cells.

Technology Process of 3-[(3E,7E,11E,15E)-18-(3,3-dimethyloxiran-2-yl)-3,7,12,16-tetramethyloctadeca-3,7,11,15-tetraenyl]-2,2-dimethyloxirane

There total 7 articles about 3-[(3E,7E,11E,15E)-18-(3,3-dimethyloxiran-2-yl)-3,7,12,16-tetramethyloctadeca-3,7,11,15-tetraenyl]-2,2-dimethyloxirane 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%

: 110390-75-5
squalene dibromohydrin: 3,22-dibromo-2,6,10,15,19,23-hexamethyl-6,10,14,18-tetracosatetraen-2,23-diol (all E)

: 654052-53-6,31063-19-1
2,3,22,23-Dioxidosqualene

Guidance literature:: With potassium carbonate; In methanol; for 2h; Ambient temperature;

Reference yield: 90.0%

: 111-02-4
2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene

: 654052-53-6,31063-19-1
2,3,22,23-Dioxidosqualene

Guidance literature:: 2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene; With N-Bromosuccinimide; water; In tetrahydrofuran; for 3h;

With potassium carbonate; In methanol; for 2h; Further stages.;
DOI:10.1039/b615897h