4H-Naphtho[2,3-b]pyran-4,6,9-trione, 5,8-bis(acetyloxy)-2-methyl-
Basic information
- CAS
62681-87-2- Standard SMILES
CC(=O)OC1=CC(=O)c2c(cc3oc(C)cc(=O)c3c2OC(C)=O)C1=O- InChIKey
ZYGUFEKZVKPFGD-UHFFFAOYSA-N- Molecular formula
- C18H12O8
- Average molar mass
- 356.3 g/mol
- Monoisotopic mass
- 356.05321734
Names & identifiers
- Preferred name
- 4H-Naphtho[2,3-b]pyran-4,6,9-trione, 5,8-bis(acetyloxy)-2-methyl-
- IUPAC
- (5-acetyloxy-2-methyl-4,6,9-trioxobenzo[g]chromen-8-yl) acetate
- English name
- 5,8-Bis(acetyloxy)-2-methyl-4H-naphtho[2,3-b]pyran-4,6,9-trione
- Molecular formula
- C18H12O8
- Molecular weight
- 356.28
Names & synonyms
4H-Naphtho[2,3-b]pyran-4,6,9-trione, 5,8-bis(acetyloxy)-2-methyl-62681-87-2DTXSID00337262ZYGUFEKZVKPFGD-UHFFFAOYSA-N5,8-Bis(acetyloxy)-2-methyl-4H-naphtho[2,3-b]pyran-4,6,9-trioneDB-3681732-Methyl-4,6,9-trioxo-6,9-dihydro-4H-naphtho[2,3-b]pyran-5,8-diyl diacetate5-(Acetyloxy)-2-methyl-4,6,9-trioxo-6,9-dihydro-4H-benzo[g]chromen-8-yl acetate #
Database identifiers
- CAS
62681-87-2- PubChem CID
- 540893
- DTXSID
DTXSID00337262- Nikkaji
- J146.897I
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 774
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Related reactions
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Compound notes
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