4-Hydroxybenzofuran-2-carbonitrile
Basic information
- CAS
53020-40-9- Standard SMILES
N#Cc1cc2c(O)cccc2o1- InChIKey
HSTGTLPDEYTSBU-UHFFFAOYSA-N- Molecular formula
- C9H5NO2
- Average molar mass
- 159.14 g/mol
- Monoisotopic mass
- 159.0320284
Names & identifiers
- Preferred name
- 4-Hydroxybenzofuran-2-carbonitrile
- IUPAC
- 4-hydroxy-1-benzofuran-2-carbonitrile
- English name
- 2-Benzofurancarbonitrile, 4-hydroxy-
- Molecular formula
- C9H5NO2
- Molecular weight
- 159.14
Names & synonyms
4-hydroxybenzofuran-2-carbonitrile53020-40-94-hydroxy-1-benzofuran-2-carbonitrile2-Benzofurancarbonitrile, 4-hydroxy-NSC171309DTXSID90305637NSC-171309DB-323724
Database identifiers
- CAS
53020-40-9- PubChem CID
- 298935
- DTXSID
DTXSID90305637
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 57.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 220
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Compound notes
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