Basic information
- CAS
111879-81-3- Standard SMILES
O=C1CCCCCCCCCCC=CCCO1- InChIKey
AGZBJJSLDGWKSU-UHFFFAOYSA-N- Molecular formula
- C15H26O2
- Average molar mass
- 238.37 g/mol
- Monoisotopic mass
- 238.19328007
Names & identifiers
- Preferred name
- CID 78653
- IUPAC
- 1-oxacyclohexadec-13-en-2-one
Names & synonyms
SCHEMBL5025730
Database identifiers
- CAS
111879-81-3- PubChem CID
- 78653
- DTXSID
DTXSID10888851
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 221
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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