2-(3-Chlorobenzylidene)-6-hydroxybenzofuran-3(2h)-one
Basic information
- CAS
620545-89-3- Standard SMILES
O=C1C(=Cc2cccc(Cl)c2)Oc2cc(O)ccc21- InChIKey
CVYVPSFTNGZDMR-UHFFFAOYSA-N- Molecular formula
- C15H9ClO3
- Average molar mass
- 272.68 g/mol
- Monoisotopic mass
- 272.0240218
Names & identifiers
- Preferred name
- 2-(3-Chlorobenzylidene)-6-hydroxybenzofuran-3(2h)-one
- IUPAC
- 2-[(3-chlorophenyl)methylidene]-6-hydroxy-1-benzofuran-3-one
Names & synonyms
620545-89-32-(3-Chlorobenzylidene)-6-hydroxybenzofuran-3(2h)-one2-[(3-Chlorophenyl)methylene]-6-hydroxy-3(2H)-benzofuranoneDTXSID9011906692-[(3-chlorophenyl)methylene]-6-hydroxy-benzofuran-3-one2-[(3-Chlorophenyl)methylidene]-6-hydroxy-1-benzofuran-3(2H)-one
Database identifiers
- CAS
620545-89-3- PubChem CID
- 3971785
- DTXSID
DTXSID901190669
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 393
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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