Basic information
- CAS
23346-42-1- Standard SMILES
CC(=O)OC1/C=C\CC/C=C\C1- InChIKey
VMVVNNQXNCQADS-NIOMPZRHSA-N- Molecular formula
- C10H14O2
- Average molar mass
- 166.22 g/mol
- Monoisotopic mass
- 166.09937969
Names & identifiers
- Preferred name
- 2,6-Cyclooctadien-1-ol, acetate
- IUPAC
- [(2Z,6Z)-cycloocta-2,6-dien-1-yl] acetate
Names & synonyms
NSC12077323346-42-12,6-Cyclooctadien-1-ol, acetateDTXSID60418622VMVVNNQXNCQADS-NIOMPZRHSA-N2,6-Cyclooctadien-1-yl acetate #NSC-120773(2Z,6Z)-CYCLOOCTA-2,6-DIEN-1-YL ACETATE
Database identifiers
- CAS
23346-42-1- PubChem CID
- 5366138
- DTXSID
DTXSID60418622
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 204
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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