2-(3,3-dimethyl-1-oxo-4,9-dihydro-2H-xanthen-9-yl)-5,5-dimethylcyclohexane-1,3-dione

Base Information

Chemical Name:2-(3,3-dimethyl-1-oxo-4,9-dihydro-2H-xanthen-9-yl)-5,5-dimethylcyclohexane-1,3-dione
CAS No.:6508-43-6
Molecular Formula:C23H26 O4
Molecular Weight:366.457
Hs Code.:
European Community (EC) Number:806-205-9
UNII:AP9351PWPR
Nikkaji Number:J3.139.248I
Wikidata:Q27163518
ChEMBL ID:CHEMBL1421016
Mol file:6508-43-6.mol

Synonyms:2(3,3-dimethyl-1-oxo-4H-1H-xanthen-9-yl)-5,5-dimethyl-cyclohexane-1,3-dione;L 152804

Suppliers and Price of 2-(3,3-dimethyl-1-oxo-4,9-dihydro-2H-xanthen-9-yl)-5,5-dimethylcyclohexane-1,3-dione

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

Usbiological
L-152,804
10mg
$ 480.00

Usbiological
L-152,804
1mg
$ 368.00

TRC
L-152,804
2.5mg
$ 195.00

Tocris
L-152,804 ≥99%(HPLC)
50
$ 927.00

Tocris
L-152,804 ≥99%(HPLC)
10
$ 225.00

Sigma-Aldrich
L-152,804 ≥98% (HPLC)
25mg
$ 375.00

Sigma-Aldrich
L-152,804 ≥98% (HPLC)
5mg
$ 99.20

ChemScene
L152804 99.89%
50mg
$ 450.00

ChemScene
L152804 99.89%
100mg
$ 750.00

ChemScene
L152804 99.89%
5mg
$ 90.00

Total 8 raw suppliers

Chemical Property of 2-(3,3-dimethyl-1-oxo-4,9-dihydro-2H-xanthen-9-yl)-5,5-dimethylcyclohexane-1,3-dione

Chemical Property:

Vapor Pressure:4.33E-11mmHg at 25°C
Melting Point:207-208 °C
Boiling Point:506.7°C at 760 mmHg
PKA:4.86±0.42(Predicted)
Flash Point:173°C
PSA：60.44000
Density:1.23g/cm³
LogP:4.38020
Storage Temp.:Desiccate at +4°C
Solubility.:DMSO: soluble5mg/mL, clear (warmed)
XLogP3:3.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:366.18310931
Heavy Atom Count:27
Complexity:707

Purity/Quality:

97% ^*data from raw suppliers

L-152,804 ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:T,N
Statements: 25-50/53
Safety Statements: 45-60-61

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1(CC(=O)C(C(=O)C1)C2C3=CC=CC=C3OC4=C2C(=O)CC(C4)(C)C)C
Uses L-152,804 is a potent and orally available Y5 antagonist, which is the receptor postulated to be responsible for hypothalamic "feeding".

Technology Process of 2-(3,3-dimethyl-1-oxo-4,9-dihydro-2H-xanthen-9-yl)-5,5-dimethylcyclohexane-1,3-dione

There total 4 articles about 2-(3,3-dimethyl-1-oxo-4,9-dihydro-2H-xanthen-9-yl)-5,5-dimethylcyclohexane-1,3-dione 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: 93.0%