Basic information
- CAS
79520-80-2- Standard SMILES
ClCCCCOc1ccc(OCCCCCl)cc1- InChIKey
SICXCTNDFJXFJV-UHFFFAOYSA-N- Molecular formula
- C14H20Cl2O2
- Average molar mass
- 291.2 g/mol
- Monoisotopic mass
- 290.0840353
Names & identifiers
- Preferred name
- 1,4-Bis(4-chlorobutoxy)benzene
- IUPAC
- 1,4-bis(4-chlorobutoxy)benzene
Names & synonyms
1,4-BIS(4-CHLOROBUTOXY)BENZENE79520-80-2SCHEMBL11091678DTXSID80608361
Database identifiers
- CAS
79520-80-2- PubChem CID
- 20523977
- DTXSID
DTXSID80608361
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 10
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 163
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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