Ethyl 2-chloro-5-iodonicotinate
Basic information
- CAS
1799421-20-7- Standard SMILES
CCOC(=O)c1cc(I)cnc1Cl- InChIKey
JCVOJRBBSLXEEJ-UHFFFAOYSA-N- Molecular formula
- C8H7ClINO2
- Average molar mass
- 311.5 g/mol
- Monoisotopic mass
- 310.921
Names & identifiers
- Preferred name
- Ethyl 2-chloro-5-iodonicotinate
- IUPAC
- ethyl 2-chloro-5-iodopyridine-3-carboxylate
Names & synonyms
Ethyl 2-chloro-5-iodonicotinate1799421-20-7SCHEMBL9383978DTXSID301199594ethyl 2-chloro-5-iodopyridine-3-carboxylate3-Pyridinecarboxylic acid, 2-chloro-5-iodo-, ethyl ester
Database identifiers
- CAS
1799421-20-7- PubChem CID
- 20073494
- DTXSID
DTXSID301199594
Properties
Computed structural properties
- XLogP
- 2.7
- 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
- 191
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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