6-Cyclopropylpyridine-2,3-dicarboxylic acid diethyl ester
Basic information
- Standard SMILES
CCOC(=O)c1ccc(C2CC2)nc1C(=O)OCC- InChIKey
FXFZBGADUPADHM-UHFFFAOYSA-N- Molecular formula
- C14H17NO4
- Average molar mass
- 263.29 g/mol
- Monoisotopic mass
- 263.11575802
Names & identifiers
- Preferred name
- 6-Cyclopropylpyridine-2,3-dicarboxylic acid diethyl ester
- IUPAC
- diethyl 6-cyclopropylpyridine-2,3-dicarboxylate
Names & synonyms
SCHEMBL9869096FXFZBGADUPADHM-UHFFFAOYSA-N6-cyclopropyl-pyridine-2,3-dicarboxylic acid diethyl ester6-cyclopropylpyridine-2,3-dicarboxylic acid diethyl ester
Database identifiers
- PubChem CID
- 14280343
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 65.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 340
Related reactions
2 records
Compound notes
Loading…