1-Phenyldecane-1,3,5,7,9-pentone
Basic information
- CAS
87994-92-1- Standard SMILES
CC(=O)CC(=O)CC(=O)CC(=O)CC(=O)c1ccccc1- InChIKey
MQGJMVHUXBMLGH-UHFFFAOYSA-N- Molecular formula
- C16H16O5
- Average molar mass
- 288.29 g/mol
- Monoisotopic mass
- 288.09977361
Names & identifiers
- Preferred name
- 1-Phenyldecane-1,3,5,7,9-pentone
- IUPAC
- 1-phenyldecane-1,3,5,7,9-pentone
Names & synonyms
1-Phenyldecane-1,3,5,7,9-pentone87994-92-1DTXSID00517709
Database identifiers
- CAS
87994-92-1- PubChem CID
- 13086370
- DTXSID
DTXSID00517709
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 85.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 444
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Related reactions
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Compound notes
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