Basic information
- CAS
89566-54-1- Standard SMILES
ClC12CCC(I)(CC1)CC2- InChIKey
AINVVISNXDTOAR-UHFFFAOYSA-N- Molecular formula
- C8H12ClI
- Average molar mass
- 270.54 g/mol
- Monoisotopic mass
- 269.96723
Names & identifiers
- Preferred name
- 1-Chloro-4-iodobicyclo[2.2.2]octane
- IUPAC
- 1-chloro-4-iodobicyclo[2.2.2]octane
Names & synonyms
89566-54-11-Chloro-4-iodobicyclo[2.2.2]octaneDTXSID40527463
Database identifiers
- CAS
89566-54-1- PubChem CID
- 13204875
- DTXSID
DTXSID40527463
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 131
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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