5H-Indeno[1,2-b]pyridine-5-carboxylic acid, 5-hydroxy-, methyl ester
Basic information
- CAS
97677-73-1- Standard SMILES
COC(=O)C1(O)c2ccccc2-c2ncccc21- InChIKey
KGSSVYVWEKTSGG-UHFFFAOYSA-N- Molecular formula
- C14H11NO3
- Average molar mass
- 241.24 g/mol
- Monoisotopic mass
- 241.07389321
Names & identifiers
- Preferred name
- 5H-Indeno[1,2-b]pyridine-5-carboxylic acid, 5-hydroxy-, methyl ester
- IUPAC
- methyl 5-hydroxyindeno[1,2-b]pyridine-5-carboxylate
Names & synonyms
5-Hydroxy-5H-indeno[1,2-b]pyridine-5-carboxylic acid methyl ester5H-Indeno[1,2-b]pyridine-5-carboxylic acid, 5-hydroxy-, methyl esterSCHEMBL6925342DTXSID80437239KGSSVYVWEKTSGG-UHFFFAOYSA-NDB-359001METHYL 5-HYDROXY-5H-INDENO[1,2-B]PYRIDINE-5-CARBOXYLATE
Database identifiers
- CAS
97677-73-1- PubChem CID
- 10243392
- DTXSID
DTXSID80437239
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 59.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 346
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
1 records
Compound notes
Loading…