Basic information
- Standard SMILES
CCOC(C)=O.c1ccncc1- InChIKey
OJAGAAVUZKMVGX-UHFFFAOYSA-N- Molecular formula
- C9H13NO2
- Average molar mass
- 167.2 g/mol
- Monoisotopic mass
- 167.09462866
Names & identifiers
- Preferred name
- Pyridine ethyl acetate
- IUPAC
- ethyl acetate;pyridine
Names & synonyms
pyridine EtOAcEtOAc Pyridineethyl acetate pyridinepyridine ethyl acetateSCHEMBL902253OJAGAAVUZKMVGX-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 21992828
Properties
Computed structural properties
- Topological polar surface area
- 39.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 80
Related reactions
6 records
Compound notes
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