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Basic information
- Standard SMILES
FC(F)(F)c1ccc(OCC(COc2c(Cl)cc(OCC=C(Cl)Cl)cc2Cl)=C(Cl)Cl)cc1- InChIKey
IWANGICTTMJHHR-UHFFFAOYSA-N- Molecular formula
- C20H13Cl6F3O3
- Average molar mass
- 571 g/mol
- Monoisotopic mass
- 567.894795
Names & identifiers
- Preferred name
- 1,3-Dichloro-5-(3,3-dichloro-allyloxy)-2-[3,3-dichloro-2-(4-trifluoromethyl-phenoxymethyl)-allyloxy]-benzene
- IUPAC
- 1,3-dichloro-5-(3,3-dichloroprop-2-enoxy)-2-[3,3-dichloro-2-[[4-(trifluoromethyl)phenoxy]methyl]prop-2-enoxy]benzene
Names & synonyms
1,3-dichloro-5-(3,3-dichloro-allyloxy)-2-[3,3-dichloro-2-(4-trifluoromethyl-phenoxymethyl)-allyloxy]-benzeneSCHEMBL4475944
Database identifiers
- PubChem CID
- 86613086
Properties
Computed structural propertiesFilling in
- XLogP
- 9.2
- Topological polar surface area
- 27.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 633
Related reactions
2 records
Compound notes
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