Basic information
- CAS
792-32-5- Standard SMILES
O=C(O)c1ccc(NC2c3ccccc3CC2O)cc1- InChIKey
ABPDYKMGWPCZKF-UHFFFAOYSA-N- Molecular formula
- C16H15NO3
- Average molar mass
- 269.29 g/mol
- Monoisotopic mass
- 269.10519334
Names & identifiers
- Preferred name
- 4-[(2-Hydroxy-2,3-dihydro-1h-inden-1-yl)amino]benzoic acid
- IUPAC
- 4-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]benzoic acid
Names & synonyms
792-32-54-[(2-hydroxy-2,3-dihydro-1h-inden-1-yl)amino]benzoic acidNSC80578DTXSID90292159NSC-80578
Database identifiers
- CAS
792-32-5- PubChem CID
- 255232
- DTXSID
DTXSID90292159
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 69.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 352
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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