1,4-Bis(3-chloropropoxy)benzene
Basic information
- CAS
79520-78-8- Standard SMILES
ClCCCOc1ccc(OCCCCl)cc1- InChIKey
UYUMFCLCGXTSQA-UHFFFAOYSA-N- Molecular formula
- C12H16Cl2O2
- Average molar mass
- 263.16 g/mol
- Monoisotopic mass
- 262.0527351
Names & identifiers
- Preferred name
- 1,4-Bis(3-chloropropoxy)benzene
- IUPAC
- 1,4-bis(3-chloropropoxy)benzene
- English name
- 1,4-Bis-(3-chloro-propoxy)-benzene
- Molecular formula
- C12H16Cl2O2
- Molecular weight
- 263.16
Names & synonyms
1,4-bis(3-chloropropoxy)benzene79520-78-8RefChem:73124Benzene, 1,4-bis(3-chloropropoxy)-1,4-Bis-(3-chloro-propoxy)-benzeneSCHEMBL3023802SCHEMBL11093336DTXSID201304483
Database identifiers
- CAS
79520-78-8- PubChem CID
- 20523958
- DTXSID
DTXSID201304483
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 141
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Compound notes
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