Costatone

Base Information

Chemical Name:Costatone
CAS No.:63023-59-6
Molecular Formula:C10H12Br2Cl2O2
Molecular Weight:394.9151
Hs Code.:
NSC Number:294580
DSSTox Substance ID:DTXSID80418548
Nikkaji Number:J18.048C
Wikidata:Q27151430
Metabolomics Workbench ID:166876
ChEMBL ID:CHEMBL1990910
Mol file:63023-59-6.mol

Synonyms:COSTATONE;63023-59-6;CHEBI:80930;NSC294580;(2S,6R)-4-chloro-2-[(Z)-1-chloroprop-1-en-2-yl]-6-(dibromomethyl)-5-methyl-2,3-dihydropyran-6-ol;CHEMBL1990910;DTXSID80418548;2H-Pyran-2-ol,6-dihydro-3-methyl-;NSC-294580;C17104;Q27151430;2H-Pyran-2-ol,6-dihydro-3-methyl-, [2R-[2.alpha.,6.beta.(Z)]]-;2H-Pyran-2-ol, 4-chloro-6-(2-chloro-1-methylethenyl)-2-(dibromomethyl)-5,6-dihydro-3-methyl-, [2R-[2.alpha.,6.beta.(Z)]]-

Suppliers and Price of Costatone

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

Total 3 raw suppliers

Chemical Property of Costatone

Chemical Property:

Vapor Pressure:2E-09mmHg at 25°C
Boiling Point:435.8°Cat760mmHg
Flash Point:217.4°C
PSA：29.46000
Density:1.82g/cm³
LogP:4.23520
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:393.85606
Heavy Atom Count:16
Complexity:342

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(CC(OC1(C(Br)Br)O)C(=CCl)C)Cl
Isomeric SMILES:CC1=C(C[C@H](O[C@]1(C(Br)Br)O)/C(=C\Cl)/C)Cl

Technology Process of Costatone

There total 1 articles about Costatone 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:

: 84926-48-7
costatolide

: 74-95-3
1,1-dibromomethane

: 63023-59-6,94904-01-5
costatone

Guidance literature:: With lithium dicyclohexylamide; Yield given. Multistep reaction; THF, -78 deg C, 1.) 20 min, 2.) 3 h;
DOI:10.1016/S0040-4039(01)91104-9