Methyl bicyclo[2.2.2]oct-5-ene-2-carboxylate
Basic information
- CAS
771-73-3- Standard SMILES
COC(=O)C1CC2C=CC1CC2- InChIKey
OBJNRAIEXAXEPB-UHFFFAOYSA-N- Molecular formula
- C10H14O2
- Average molar mass
- 166.22 g/mol
- Monoisotopic mass
- 166.09937969
Names & identifiers
- Preferred name
- Methyl bicyclo[2.2.2]oct-5-ene-2-carboxylate
- IUPAC
- methyl bicyclo[2.2.2]oct-5-ene-2-carboxylate
Names & synonyms
methyl bicyclo[2.2.2]oct-5-ene-2-carboxylate771-73-3NSC167503SCHEMBL11277895SCHEMBL11801332DTXSID90304827NSC-167503
Database identifiers
- CAS
771-73-3- PubChem CID
- 296932
- DTXSID
DTXSID90304827- Nikkaji
- J1.520.744B
Properties
Computed structural properties
- XLogP
- 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
- 220
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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