Basic information
- CAS
1312903-94-8- Standard SMILES
CCOC(=O)c1ccc(OCC)cn1- InChIKey
GURVKDSNNLEJBB-UHFFFAOYSA-N- Molecular formula
- C10H13NO3
- Average molar mass
- 195.21 g/mol
- Monoisotopic mass
- 195.08954328
Names & identifiers
- Preferred name
- Ethyl 5-ethoxypicolinate
- IUPAC
- ethyl 5-ethoxypyridine-2-carboxylate
Names & synonyms
Ethyl 5-ethoxypicolinate1312903-94-8ethyl 5-ethoxypyridine-2-carboxylate2-Pyridinecarboxylic acid, 5-ethoxy-, ethyl esterEthyl5-ethoxypicolinateSCHEMBL9901416DTXSID40737848GURVKDSNNLEJBB-UHFFFAOYSA-N
Database identifiers
- CAS
1312903-94-8- PubChem CID
- 67958698
- DTXSID
DTXSID40737848
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 48.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 184
Related reactions
4 records
Compound notes
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