Basic information
- Standard SMILES
COC(=O)CCc1ncccc1O- InChIKey
YLSVOBAGIIMKRZ-UHFFFAOYSA-N- Molecular formula
- C9H11NO3
- Average molar mass
- 181.19 g/mol
Names & identifiers
- Preferred name
- 3-(3-Hydroxy-2-pyridyl)-propionic acid methyl ester
- IUPAC
- methyl 3-(3-hydroxy-2-pyridinyl)propanoate
Names & synonyms
SCHEMBL8825478YLSVOBAGIIMKRZ-UHFFFAOYSA-N3-(3-hydroxy-2-pyridyl)-propionic acid methyl ester
Database identifiers
- PubChem CID
- 54514901
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 59.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 172
Related reactions
4 records
Compound notes
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