O-Methyl Atovaquone

Base Information

• Chemical Name: O-Methyl Atovaquone
• CAS No.: 129700-41-0
• Molecular Weight: 380.86
• European Community (EC) Number: 689-806-7
• UNII: CJ80ZA89HA
• Mol file: 129700-41-0.mol

Synonyms:O-Methyl Atovaquone;129700-41-0;CJ80ZA89HA;UNII-CJ80ZA89HA;O-Methyl atovaquone [USP];2-[4-(4-chlorophenyl)cyclohexyl]-3-methoxynaphthalene-1,4-dione;2-(trans-4-(4-Chlorophenyl)cyclohexyl)-3-methoxy-1,4-naphthalenedione;trans-2-(4-(4-Chlorophenyl)cyclohexyl)-3-methoxy-1,4-naphthoquinone;1,4-Naphthalenedione, 2-(4-(4-chlorophenyl)cyclohexyl)-3-methoxy-, trans-;SCHEMBL9145234;SCHEMBL9145242;O-METHYL ATOVAQUONE [USP IMPURITY];Rel-2-((1r,4r)-4-(4-chlorophenyl)cyclohexyl)-3-methoxynaphthalene-1,4-dione

Chemical Property of O-Methyl Atovaquone

Chemical Property:

• Boiling Point: 538.9±50.0 °C(Predicted)
• Density: 1.28±0.1 g/cm3(Predicted)
• XLogP3: 6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 380.1179222
• Heavy Atom Count: 27
• Complexity: 609

Purity/Quality:

> 95% ^*data from raw suppliers

O-MethylAtovaquone ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC1=C(C(=O)C2=CC=CC=C2C1=O)C3CCC(CC3)C4=CC=C(C=C4)Cl
• Uses: O-Methyl Atovaquone is a Atovaquone derivative that shows protozoacidal activity against Plasmodium falciparum.