6-Oxabicyclo[3.2.1]oct-2-en-7-one
Basic information
- Standard SMILES
O=C1OC2CC=CC1C2- InChIKey
LEPIIFKETJFCNZ-UHFFFAOYSA-N- Molecular formula
- C7H8O2
- Average molar mass
- 124.14 g/mol
- Monoisotopic mass
- 124.05242949
Names & identifiers
- Preferred name
- 6-Oxabicyclo[3.2.1]oct-2-en-7-one
- IUPAC
- 6-oxabicyclo[3.2.1]oct-2-en-7-one
Names & synonyms
NSC620031CHEMBL1983420NSC-620031NCI60_005909
Database identifiers
- PubChem CID
- 359287
- ChEMBL
CHEMBL1983420
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 172
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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