Basic information
- CAS
31689-25-5- Standard SMILES
O=C1C=C(CCC2=CC(=O)c3ccccc3C2=O)C(=O)c2ccccc21- InChIKey
JDEWXUIKOKUSAO-UHFFFAOYSA-N- Molecular formula
- C22H14O4
- Average molar mass
- 342.3 g/mol
- Monoisotopic mass
- 342.08920892
Names & identifiers
- Preferred name
- 1,4-Naphthalenedione, 2,2'-(1,2-ethanediyl)bis-
- IUPAC
- 2-[2-(1,4-dioxonaphthalen-2-yl)ethyl]naphthalene-1,4-dione
Names & synonyms
31689-25-51,4-Naphthalenedione, 2,2'-(1,2-ethanediyl)bis-QWE5WBP6GNUNII-QWE5WBP6GNNSC375297NSC 3752972,2'-(1,2-Ethanediyl)bis(1,4-naphthalenedione)NSC-375297SCHEMBL5810776DTXSID401855821,4-NAPHTHOQUINONE, 2,2'-ETHYLENEDI-2,2'-(Ethane-1,2-diyl)di(naphthalene-1,4-dione)
Show more names
2-[2-(1,4-dioxo-2-naphthyl)ethyl]naphthalene-1,4-dione
Database identifiers
- CAS
31689-25-5- PubChem CID
- 341807
- DTXSID
DTXSID40185582- UNII
- QWE5WBP6GN
- Nikkaji
- J1.687.580E
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 68.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 664
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…