Basic information
- CAS
114032-22-3- Standard SMILES
COC1=CC(=O)c2cc(C)cc(-c3cc4ccc(=O)oc4cc3OC)c2C1=O- InChIKey
MSDIEAZOLJWCBV-UHFFFAOYSA-N- Molecular formula
- C22H16O6
- Average molar mass
- 376.4 g/mol
- Monoisotopic mass
- 376.09468823
Overview
Naphthoherniarin is a naphthoquinone.
Names & identifiers
- Preferred name
- Naphthoherniarin
- IUPAC
- 2-methoxy-8-(7-methoxy-2-oxochromen-6-yl)-6-methylnaphthalene-1,4-dione
Names & synonyms
NaphthoherniarinNSC6283632-Methoxy-8-(7-methoxy-2-oxo-2H-chromen-6-yl)-6-methylnaphthoquinoneCHEBI:169827DTXSID9011340532-methoxy-8-(7-methoxy-2-oxochromen-6-yl)-6-methylnaphthalene-1,4-dioneNSC-628363114032-22-32-Methoxy-8-(7-methoxy-2-oxo-2H-1-benzopyran-6-yl)-6-methyl-1,4-naphthalenedione2-Methoxy-8-(7-methoxy-2-oxo-2H-1-benzopyran-6-yl)-6-methyl-1,4-naphthalenedione, 9CI2-Methoxy-8-(7-methoxy-2-oxo-2H-1-benzopyran-6-yl)-6-methylnaphthalene-1,4-dione2-methoxy-8-(7-methoxy-2-oxo-2H-chromen-6-yl)-6-methyl-1,4-dihydronaphthalene-1,4-dione
Show more names
2-methoxy-8-(7-methoxy-2-oxo-chromen-6-yl)-6-methyl-naphthalene-1,4-dione
Database identifiers
- CAS
114032-22-3- PubChem CID
- 363452
- DTXSID
DTXSID901134053- ChEBI
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 737
Experimental & physicochemical properties
Melting Point285 °C
Physical DescriptionSolid
Chemistry & industry
Pharmacology
Cellular LocationsMembrane
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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