Phenol, 2,3,4-trichloro-6-(2,3,4,5,6-pentachlorophenoxy)-
Basic information
- CAS
90986-07-5- Standard SMILES
Oc1c(Oc2c(Cl)c(Cl)c(Cl)c(Cl)c2Cl)cc(Cl)c(Cl)c1Cl- InChIKey
GFZVPDZHLHEIKJ-UHFFFAOYSA-N- Molecular formula
- C12H2Cl8O2
- Average molar mass
- 461.8 g/mol
- Monoisotopic mass
- 457.756301
Names & identifiers
- Preferred name
- Phenol, 2,3,4-trichloro-6-(2,3,4,5,6-pentachlorophenoxy)-
- IUPAC
- 2,3,4-trichloro-6-(2,3,4,5,6-pentachlorophenoxy)phenol
Names & synonyms
90986-07-5Phenol, 2,3,4-trichloro-6-(2,3,4,5,6-pentachlorophenoxy)-DTXSID40238340Phenol, 2,3,4-trichloro-6-(pentachlorophenoxy)-RefChem:368891DTXCID601608312,3,4-trichloro-6-(pentachlorophenoxy)phenol
Database identifiers
- CAS
90986-07-5- PubChem CID
- 185060
- DTXSID
DTXSID40238340
Properties
Computed structural properties
- XLogP
- 8.1
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 372
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Compound notes
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