7,8-Dihydro-5h-benzo[7]annulene-5,9(6h)-dione
Basic information
- CAS
54034-10-5- Standard SMILES
O=C1CCCC(=O)c2ccccc21- InChIKey
HDTWXKYZOSMJTP-UHFFFAOYSA-N- Molecular formula
- C11H10O2
- Average molar mass
- 174.2 g/mol
- Monoisotopic mass
- 174.06807956
Names & identifiers
- Preferred name
- 7,8-Dihydro-5h-benzo[7]annulene-5,9(6h)-dione
- IUPAC
- 7,8-dihydro-6H-benzo[7]annulene-5,9-dione
Names & synonyms
7,8-dihydro-5h-benzo[7]annulene-5,9(6h)-dione54034-10-5NSC105600NCIOpen2_001959DTXSID20968875NSC-105600
Database identifiers
- CAS
54034-10-5- PubChem CID
- 266803
- DTXSID
DTXSID20968875- Nikkaji
- J371.723B
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 208
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Compound notes
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