1-Chloro-4-[3-(phenylsulfanyl)propoxy]benzene
Basic information
- CAS
90184-20-6- Standard SMILES
Clc1ccc(OCCCSc2ccccc2)cc1- InChIKey
DYSOMYHOEYYXPL-UHFFFAOYSA-N- Molecular formula
- C15H15ClOS
- Average molar mass
- 278.8 g/mol
- Monoisotopic mass
- 278.053214
Names & identifiers
- Preferred name
- 1-Chloro-4-[3-(phenylsulfanyl)propoxy]benzene
- IUPAC
- 1-chloro-4-(3-phenylsulfanylpropoxy)benzene
Names & synonyms
90184-20-61-CHLORO-4-[3-(PHENYLSULFANYL)PROPOXY]BENZENESCHEMBL1445768SCHEMBL1445771DTXSID00736251
Database identifiers
- CAS
90184-20-6- PubChem CID
- 67036660
- DTXSID
DTXSID00736251
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 34.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 211
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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