Basic information
- CAS
85269-46-1- Standard SMILES
CCCCCC(Cl)C(Cl)CCl- InChIKey
ADQWLUCCIPZTLX-UHFFFAOYSA-N- Molecular formula
- C8H15Cl3
- Average molar mass
- 217.6 g/mol
- Monoisotopic mass
- 216.023934
Names & identifiers
- Preferred name
- 1,2,3-Trichlorooctane
- IUPAC
- 1,2,3-trichlorooctane
Names & synonyms
1,2,3-TRICHLOROOCTANE85269-46-1DTXSID801005756
Database identifiers
- CAS
85269-46-1- PubChem CID
- 55322
- DTXSID
DTXSID801005756- Nikkaji
- J1.596.961J
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 6
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 85.4
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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