2-Morpholin-4-ylnaphthalene-1,4-dione
Basic information
- CAS
24555-42-8- Standard SMILES
O=C1C=C(N2CCOCC2)C(=O)c2ccccc21- InChIKey
VEHBXPMGNIAHNU-UHFFFAOYSA-N- Molecular formula
- C14H13NO3
- Average molar mass
- 243.26 g/mol
- Monoisotopic mass
- 243.08954328
Names & identifiers
- Preferred name
- 2-Morpholin-4-ylnaphthalene-1,4-dione
- IUPAC
- 2-morpholin-4-ylnaphthalene-1,4-dione
Names & synonyms
2-morpholin-4-ylnaphthalene-1,4-dione24555-42-8DTXSID50351731RefChem:264035DTXCID403027972-morpholinonaphthalene-1,4-dione2-(morpholin-4-yl)naphthalene-1,4-dione2-morpholino-1,4-naphthoquinone1,4-Naphthalenedione, 2-(4-morpholinyl)-ChemDiv3_001778SCHEMBL247037CHEMBL420680
Show more names
VEHBXPMGNIAHNU-UHFFFAOYSA-NHMS1478A18STK700119AKOS0036136682-Morpholin-4-yl-[1,4]naphthoquinoneIDI1_020744ST037415EU-0040252
Database identifiers
- CAS
24555-42-8- PubChem CID
- 708162
- DTXSID
DTXSID50351731- ChEMBL
CHEMBL420680- Nikkaji
- J370.288J
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 396
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Related reactions
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Compound notes
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