8-Methyloxecane-2,7-dione
Basic information
- CAS
16121-05-4- Standard SMILES
CC1CCOC(=O)CCCCC1=O- InChIKey
CWAINCBOQQCYQY-UHFFFAOYSA-N- Molecular formula
- C10H16O3
- Average molar mass
- 184.23 g/mol
- Monoisotopic mass
- 184.10994437
Names & identifiers
- Preferred name
- 8-Methyloxecane-2,7-dione
- IUPAC
- 8-methyloxecane-2,7-dione
Names & synonyms
16121-05-48-methyloxecane-2,7-dioneNSC106095DTXSID10295889NSC-106095
Database identifiers
- CAS
16121-05-4- PubChem CID
- 266997
- DTXSID
DTXSID10295889
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 198
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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