1,4-Dichloro-2,5-bis[(2-chloroethoxy)methyl]benzene
Basic information
- CAS
5409-85-8- Standard SMILES
ClCCOCc1cc(Cl)c(COCCCl)cc1Cl- InChIKey
XCBCXWOBSVKKII-UHFFFAOYSA-N- Molecular formula
- C12H14Cl4O2
- Average molar mass
- 332 g/mol
- Monoisotopic mass
- 329.97479
Names & identifiers
- Preferred name
- 1,4-Dichloro-2,5-bis[(2-chloroethoxy)methyl]benzene
- IUPAC
- 1,4-dichloro-2,5-bis(2-chloroethoxymethyl)benzene
Names & synonyms
5409-85-81,4-dichloro-2,5-bis[(2-chloroethoxy)methyl]benzeneNSC12537DTXSID20968951NSC-12537
Database identifiers
- CAS
5409-85-8- PubChem CID
- 224201
- DTXSID
DTXSID20968951
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 196
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Compound notes
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