Dimethyl acenaphthylene-5,6-dicarboxylate
Basic information
- CAS
92964-95-9- Standard SMILES
COC(=O)c1ccc2c3c(ccc(C(=O)OC)c13)C=C2- InChIKey
BINLBFOXUUZORY-UHFFFAOYSA-N- Molecular formula
- C16H12O4
- Average molar mass
- 268.26 g/mol
- Monoisotopic mass
- 268.07355886
Names & identifiers
- Preferred name
- Dimethyl acenaphthylene-5,6-dicarboxylate
- IUPAC
- dimethyl acenaphthylene-5,6-dicarboxylate
Names & synonyms
dimethyl acenaphthylene-5,6-dicarboxylate92964-95-9NSC109922DTXSID00918813NSC-109922SR-01000027748SR-01000027748-1
Database identifiers
- CAS
92964-95-9- PubChem CID
- 269265
- DTXSID
DTXSID00918813
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 404
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Compound notes
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