1-(2-Chloroethoxy)-4-nonylbenzene
Basic information
- CAS
20543-09-3- Standard SMILES
CCCCCCCCCc1ccc(OCCCl)cc1- InChIKey
OBCNFGRCVPJZEP-UHFFFAOYSA-N- Molecular formula
- C17H27ClO
- Average molar mass
- 282.8 g/mol
- Monoisotopic mass
- 282.1750432
Names & identifiers
- Preferred name
- 1-(2-Chloroethoxy)-4-nonylbenzene
- IUPAC
- 1-(2-chloroethoxy)-4-nonylbenzene
- English name
- 1-(2-chloroethoxy)-4-nonylbenzene
- Molecular formula
- C17H27ClO
- Molecular weight
- 282.85
Names & synonyms
1-(2-Chloroethoxy)-4-nonylbenzene20543-09-3EINECS 243-868-8DTXSID10174544RefChem:74098DTXCID0097035243-868-8OBCNFGRCVPJZEP-UHFFFAOYSA-Np-n-nonyl-phenyl 2-chloroethyl etherDB-300418NS00026679Benzene, 1-(2-chloroethoxy)-4-nonyl-
Database identifiers
- CAS
20543-09-3- PubChem CID
- 88586
- DTXSID
DTXSID10174544- EC Number
- 243-868-8
- Nikkaji
- J280.611H
Properties
Computed structural properties
- XLogP
- 6.8
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 11
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 188
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
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Compound notes
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