3-Methylanthra[1,2-c]isoxazole-6,11-dione
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Basic information
- CAS
58369-03-2- Standard SMILES
Cc1onc2c3c(ccc12)C(=O)c1ccccc1C3=O- InChIKey
IGPNWOMDIBWEAT-UHFFFAOYSA-N- Molecular formula
- C16H9NO3
- Average molar mass
- 263.25 g/mol
- Monoisotopic mass
- 263.05824315
Names & identifiers
- Preferred name
- 3-Methylanthra[1,2-c]isoxazole-6,11-dione
- IUPAC
- 3-methylnaphtho[2,3-g][2,1]benzoxazole-6,11-dione
- English name
- 3-methylanthra[1,2-c]isoxazole-6,11-dione
- Molecular formula
- C16H9NO3
- Molecular weight
- 263.25
Names & synonyms
58369-03-23-Methylanthra(1,2-c)isoxazole-6,11-dioneEINECS 261-224-43-methylanthra[1,2-c]isoxazole-6,11-dioneDTXSID90207086RefChem:94828DTXCID90129577261-224-4SCHEMBL27880896IGPNWOMDIBWEAT-UHFFFAOYSA-NDB-241166NS00033914
Show more names
Anthra[1,2-c]isoxazole-6,11-dione, 3-methyl-
3-methylanthra[1,2-c][1,2]oxazole-6,11-dione
Database identifiers
- CAS
58369-03-2- PubChem CID
- 94030
- DTXSID
DTXSID90207086- EC Number
- 261-224-4
- Nikkaji
- J296.925D
Properties
Computed structural propertiesFilling in
- XLogP
- 3.1
- Topological polar surface area
- 60.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 449
Related reactions
0 records
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Compound notes
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