Basic information
- Standard SMILES
CCOC(=O)c1ccc(C)c(C)n1- InChIKey
AQAGWGBFNHFMLO-UHFFFAOYSA-N- Molecular formula
- C10H13NO2
- Average molar mass
- 179.22 g/mol
- Monoisotopic mass
- 179.09462866
Names & identifiers
- Preferred name
- Ethyl 5,6-dimethylpicolinate
- IUPAC
- ethyl 5,6-dimethylpyridine-2-carboxylate
Names & synonyms
ethyl 5,6-dimethylpicolinate25863-27-85,6-Dimethylpyridine-2-carboxylic acid ethyl esterethyl 5,6-dimethylpyridine-2-carboxylateethyl5,6-dimethylpicolinateSCHEMBL1179292AQAGWGBFNHFMLO-UHFFFAOYSA-NDB-3406235,6-dimethyl-pyridine-2-carboxilic acid ethyl ester5,6-dimethyl-pyridine-2-carboxylic acid ethyl ester
Database identifiers
- PubChem CID
- 66933514
- Nikkaji
- J3.172.846K
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 39.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 182
Related reactions
2 records
Compound notes
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