Basic information
- CAS
29480-42-0- Standard SMILES
ClC1=CCCC=C(Cl)CC1- InChIKey
KBTPRKBSGQDFGW-UHFFFAOYSA-N- Molecular formula
- C8H10Cl2
- Average molar mass
- 177.07 g/mol
- Monoisotopic mass
- 176.0159557
Names & identifiers
- Preferred name
- CID 34601
- IUPAC
- 1,6-dichlorocycloocta-1,5-diene
Names & synonyms
29480-42-0SCHEMBL9169364
Database identifiers
- CAS
29480-42-0- PubChem CID
- 34601
- DTXSID
DTXSID0073459
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 148
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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