Basic information
- CAS
56818-02-1- Standard SMILES
CCOc1c(Cl)cc(Cl)c(Cl)c1Cl- InChIKey
OMGPLLBLNOWRAA-UHFFFAOYSA-N- Molecular formula
- C8H6Cl4O
- Average molar mass
- 259.9 g/mol
- Monoisotopic mass
- 257.917276
Names & identifiers
- Preferred name
- 1,2,3,5-Tetrachloro-4-ethoxybenzene
- IUPAC
- 1,2,3,5-tetrachloro-4-ethoxybenzene
- English name
- 1,2,3,5-Tetrachloro-4-ethoxybenzene
- Molecular formula
- C8H6Cl4O
- Molecular weight
- 259.94
Names & synonyms
2,3,4,6-Tetrachlorophenetole1,2,3,5-Tetrachloro-4-ethoxybenzene56818-02-1Benzene, 1,2,3,5-tetrachloro-4-ethoxy-DTXSID6012942301,2,3,5-Tetrachloro-4-ethoxybenzene #DB-3009002,4,5,6-Tetrachlorophenylethyl ether
Database identifiers
- CAS
56818-02-1- PubChem CID
- 616073
- DTXSID
DTXSID601294230- Nikkaji
- J117.114C
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 166
Physicochemical properties
- Melting point
- 55 °C · 55 °C
- Boiling point
- 304.4 · 304.4±37.0 °C(Predicted)
- Density
- 1.462 · 1.462±0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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