Ether, bis(tetrachlorophenyl)
Basic information
- CAS
27176-82-5- Standard SMILES
ClC1=CCC(Cl)(OC2(Cl)CC=C(Cl)C(Cl)=C2Cl)C(Cl)=C1Cl- InChIKey
QQUOXRKHDWTZIM-UHFFFAOYSA-N- Molecular formula
- C12H6Cl8O
- Average molar mass
- 449.8 g/mol
- Monoisotopic mass
- 445.792686
Names & identifiers
- Preferred name
- Ether, bis(tetrachlorophenyl)
- IUPAC
- 1,2,3,6-tetrachloro-6-(1,2,3,4-tetrachlorocyclohexa-2,4-dien-1-yl)oxycyclohexa-1,3-diene
Names & synonyms
27176-82-5Ether, bis(tetrachlorophenyl)1,1'-Oxybis(tetrachlorobenzene)Benzene, 1,1'-oxybis(tetrachloro-5,5'-oxybis(2,3,4,5-tetrachlorocyclohexa-1,3-diene)DTXSID70949917
Database identifiers
- CAS
27176-82-5- PubChem CID
- 190280
- DTXSID
DTXSID70949917
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 552
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Compound notes
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