3,4-Pyridinedicarboxylic acid, 6-amino-2-methoxy-, dimethyl ester
Basic information
- CAS
149726-21-6- Standard SMILES
COC(=O)c1cc(N)nc(OC)c1C(=O)OC- InChIKey
FXJMTBSGFQBKSY-UHFFFAOYSA-N- Molecular formula
- C10H12N2O5
- Average molar mass
- 240.21 g/mol
- Monoisotopic mass
- 240.07462149
Names & identifiers
- Preferred name
- 3,4-Pyridinedicarboxylic acid, 6-amino-2-methoxy-, dimethyl ester
- IUPAC
- dimethyl 6-amino-2-methoxypyridine-3,4-dicarboxylate
Names & synonyms
149726-21-63,4-Pyridinedicarboxylic acid, 6-amino-2-methoxy-, dimethyl ester2-amino-4,5-dicarbomethoxy-6-methoxypyridinedimethyl 6-amino-2-methoxypyridine-3,4-dicarboxylateDTXSID50415827InChI=1/C10H12N2O5/c1-15-8-7(10(14)17-3)5(9(13)16-2)4-6(11)12-8/h4H,1-3H3,(H2,11,12
Database identifiers
- CAS
149726-21-6- PubChem CID
- 5323745
- DTXSID
DTXSID50415827
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 296
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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