(Bromoethynyl)cyclohexane
Basic information
- CAS
66684-39-7- Standard SMILES
BrC#CC1CCCCC1- InChIKey
NNWNSPVYMRKLFX-UHFFFAOYSA-N- Molecular formula
- C8H11Br
- Average molar mass
- 187.08 g/mol
- Monoisotopic mass
- 186.00441
Names & identifiers
- Preferred name
- (Bromoethynyl)cyclohexane
- IUPAC
- 2-bromoethynylcyclohexane
Names & synonyms
(bromoethynyl)cyclohexane66684-39-7DTXSID20301889RefChem:210187DTXCID90253023NSC147113SCHEMBL3346553SCHEMBL29159463SCHEMBL31261819NSC-147113
Database identifiers
- CAS
66684-39-7- PubChem CID
- 287334
- DTXSID
DTXSID20301889- Nikkaji
- J452.368G
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 131
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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