[2,3,4,5,6-Pentakis[[2-(2,4-dichlorophenoxy)acetyl]oxy]cyclohexyl] 2-(2,4-dichlorophenoxy)acetate
Basic information
- CAS
7460-63-1- Standard SMILES
O=C(COc1ccc(Cl)cc1Cl)OC1C(OC(=O)COc2ccc(Cl)cc2Cl)C(OC(=O)COc2ccc(Cl)cc2Cl)C(OC(=O)COc2ccc(Cl)cc2Cl)C(OC(=O)COc2ccc(Cl)cc2Cl)C1OC(=O)COc1ccc(Cl)cc1Cl- InChIKey
WNDSREDFJWDHDR-UHFFFAOYSA-N- Molecular formula
- C54H36Cl12O18
- Average molar mass
- 1,398.3 g/mol
- Monoisotopic mass
- 1,391.816397
Names & identifiers
- Preferred name
- [2,3,4,5,6-Pentakis[[2-(2,4-dichlorophenoxy)acetyl]oxy]cyclohexyl] 2-(2,4-dichlorophenoxy)acetate
- IUPAC
- [2,3,4,5,6-pentakis[[2-(2,4-dichlorophenoxy)acetyl]oxy]cyclohexyl] 2-(2,4-dichlorophenoxy)acetate
Names & synonyms
NSC345807460-63-1SCHEMBL25583200DTXSID40283971NSC-34580cyclohexane-1,2,3,4,5,6-hexayl hexakis[(2,4-dichlorophenoxy)acetate]
Database identifiers
- CAS
7460-63-1- PubChem CID
- 234545
- DTXSID
DTXSID40283971
Properties
Computed structural properties
- XLogP
- 17.5
- Topological polar surface area
- 213 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 18
- Rotatable bonds
- 30
- Heavy atoms
- 84
- Formal charge
- 0
- Complexity
- 1,760
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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