Basic information
- Standard SMILES
N#Cc1cc(C=O)ccc1Oc1cnc(F)c(F)c1- InChIKey
JQJKDIGIFFGJAT-UHFFFAOYSA-N- Molecular formula
- C13H6F2N2O2
- Average molar mass
- 260.19 g/mol
Names & identifiers
- Preferred name
- 2-((5,6-Difluoropyridin-3-yl)oxy)-5-formylbenzonitrile
- IUPAC
- 2-[(5,6-difluoro-3-pyridinyl)oxy]-5-formylbenzonitrile
Names & synonyms
SCHEMBL14662724JQJKDIGIFFGJAT-UHFFFAOYSA-N2-((5,6-difluoropyridin-3-yl)oxy)-5-formylbenzonitrile
Database identifiers
- PubChem CID
- 86724166
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 63 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 371
Related reactions
1 records
Compound notes
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