Buparvaquone

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Catalog Number ACM88426339
Product Name Buparvaquone
CAS Number 88426-33-9
Structure Buparvaquone
Description Buparvaquone is a hydroxynaphthoquinone antiprotozoal agent related to parvaquone and atovaquone.
IUPAC Name 3-[(4-tert-butylcyclohexyl)methyl]-4-hydroxynaphthalene-1,2-dione
Synonyms 1,4-Naphthalenedione, 2-[[4-(1,1-Dimethylethyl)Cyclohexyl]Methyl]-3-Hydroxy-
Molecular Weight 326.43
Molecular Formula C21H26O3
Canonical SMILES CC(C)(C)C1CCC(CC1)CC2=C(C3=CC=CC=C3C(=O)C2=O)O
Inchi InChI=1S/C21H26O3/c1-21(2,3)14-10-8-13(9-11-14)12-17-18(22)15-6-4-5-7-16(15)19(23)20(17)24/h4-7,13-14,22H,8-12H2,1-3H3
InChIKey NEGDTWQGGLJCTL-UHFFFAOYSA-N
Boiling Point 460.7±45.0 °C at 760 mmHg
Melting Point 178-184 ºC
Flash Point 246.5±25.2 °C
Purity 98%
Density 1.2±0.1 g/cm3
Appearance Crystalline
Storage Powder-20°C, 3 years; 4°C, 2 years; In solvent-80°C, 6 months; -20°C, 1 month.
Refractive Index 1.574

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