Basic information
- Standard SMILES
COCc1c(OC)nc(C(C)C)c(C=O)c1-c1ccc(F)cc1- InChIKey
IFTCKFXTRCZTJV-UHFFFAOYSA-N- Molecular formula
- C18H20FNO3
- Average molar mass
- 317.4 g/mol
Names & identifiers
- Preferred name
- 4-(4-Fluorophenyl)-6-isopropyl-2-methoxy-3-methoxymethyl-pyridine-5-carbaldehyde
- IUPAC
- 4-(4-fluorophenyl)-6-methoxy-5-(methoxymethyl)-2-propan-2-ylpyridine-3-carbaldehyde
Names & synonyms
SCHEMBL8953562IFTCKFXTRCZTJV-UHFFFAOYSA-N4-(4-Fluorophenyl)-6-isopropyl-2-methoxy-3-methoxymethyl-pyridine-5-carbaldehyde
Database identifiers
- PubChem CID
- 19936693
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 48.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 371
Related reactions
1 records
Compound notes
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