Basic information
- CAS
820974-75-2- Standard SMILES
N#CC1CCc2c(O)cccc21- InChIKey
LYYJWSZEDINELS-UHFFFAOYSA-N- Molecular formula
- C10H9NO
- Average molar mass
- 159.18 g/mol
- Monoisotopic mass
- 159.06841391
Names & identifiers
- Preferred name
- 4-Hydroxy-2,3-dihydro-1H-indene-1-carbonitrile
- IUPAC
- 4-hydroxy-2,3-dihydro-1H-indene-1-carbonitrile
Names & synonyms
4-Hydroxy-2,3-dihydro-1H-indene-1-carbonitrile820974-75-2DTXSID10839368
Database identifiers
- CAS
820974-75-2- PubChem CID
- 71420161
- DTXSID
DTXSID10839368
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 44 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 217
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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