Basic information
- CAS
40745-37-7- Standard SMILES
O=C(O)C(C(=O)O)C1Cc2cccc3cccc1c23- InChIKey
YYWXGCHGKLJVAE-UHFFFAOYSA-N- Molecular formula
- C15H12O4
- Average molar mass
- 256.25 g/mol
- Monoisotopic mass
- 256.07355886
Names & identifiers
- Preferred name
- 1-Acenaphthenemalonic acid
- IUPAC
- 2-(1,2-dihydroacenaphthylen-1-yl)propanedioic acid
Names & synonyms
1-Acenaphthenemalonic acid40745-37-7NSC144488NSC-144488
Database identifiers
- CAS
40745-37-7- PubChem CID
- 286396
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 378
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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