Basic information
- CAS
90985-94-7- Standard SMILES
COc1c(Cl)cc(Oc2c(Cl)cc(Cl)cc2Cl)cc1Cl- InChIKey
UZSFJBPWIONKLW-UHFFFAOYSA-N- Molecular formula
- C13H7Cl5O2
- Average molar mass
- 372.4 g/mol
- Monoisotopic mass
- 369.888868
Names & identifiers
- Preferred name
- 1,3-Dichloro-2-methoxy-5-(2,4,6-trichlorophenoxy)benzene
- IUPAC
- 1,3,5-trichloro-2-(3,5-dichloro-4-methoxyphenoxy)benzene
Names & synonyms
1,3-Dichloro-2-methoxy-5-(2,4,6-trichlorophenoxy)benzene90985-94-7DTXSID70238338
Database identifiers
- CAS
90985-94-7- PubChem CID
- 56161
- DTXSID
DTXSID70238338- Nikkaji
- J1.598.256J
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 295
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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