Basic information
- Standard SMILES
CCCc1nc(C=O)c(Cl)c(N)c1F- InChIKey
APLHNJCTVSJQQB-UHFFFAOYSA-N- Molecular formula
- C9H10ClFN2O
- Average molar mass
- 216.64 g/mol
- Monoisotopic mass
- 216.0465688
Names & identifiers
- Preferred name
- 4-Amino-3-chloro-5-fluoro-6-propylpicolinaldehyde
- IUPAC
- 4-amino-3-chloro-5-fluoro-6-propylpyridine-2-carbaldehyde
Names & synonyms
SCHEMBL15791810APLHNJCTVSJQQB-UHFFFAOYSA-N4-amino-3-chloro-5-fluoro-6-propylpicolinaldehyde4-amino-3-chloro-6-propyl-5-fluoropicolinaldehyde
Database identifiers
- PubChem CID
- 86723400
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 56 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 205
Related reactions
2 records
Linked notes
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