2-(3-Chlorophenyl)-3-(trifluoromethyl)-1-benzofuran
Basic information
- CAS
821769-98-6- Standard SMILES
FC(F)(F)c1c(-c2cccc(Cl)c2)oc2ccccc12- InChIKey
HVPNLQKHLMQNBM-UHFFFAOYSA-N- Molecular formula
- C15H8ClF3O
- Average molar mass
- 296.67 g/mol
- Monoisotopic mass
- 296.0215771
Names & identifiers
- Preferred name
- 2-(3-Chlorophenyl)-3-(trifluoromethyl)-1-benzofuran
- IUPAC
- 2-(3-chlorophenyl)-3-(trifluoromethyl)-1-benzofuran
Names & synonyms
821769-98-62-(3-Chlorophenyl)-3-(trifluoromethyl)-1-benzofuranDTXSID60839196RefChem:251481DTXCID907899382-(3-Chlorophenyl)-3-(trifluoromethyl)benzofuran
Database identifiers
- CAS
821769-98-6- PubChem CID
- 71419982
- DTXSID
DTXSID60839196- Nikkaji
- J2.125.813J
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 13.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 347
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Compound notes
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