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Basic information
- CAS
318684-48-9- Standard SMILES
O=[N+]([O-])c1cnc2c(F)c(Cl)c(F)cc2c1- InChIKey
VYIMRAVVVCSDQE-UHFFFAOYSA-N- Molecular formula
- C9H3ClF2N2O2
- Average molar mass
- 244.58 g/mol
- Monoisotopic mass
- 243.9851114
Names & identifiers
- Preferred name
- 7-Chloro-6,8-difluoro-3-nitroquinoline
- IUPAC
- 7-chloro-6,8-difluoro-3-nitroquinoline
Names & synonyms
7-chloro-6,8-difluoro-3-nitroquinolineSCHEMBL7078192VYIMRAVVVCSDQE-UHFFFAOYSA-NDTXSID601283681318684-48-9
Database identifiers
- CAS
318684-48-9- PubChem CID
- 18523331
- DTXSID
DTXSID601283681
Properties
Computed structural propertiesFilling in
- XLogP
- 2.8
- Topological polar surface area
- 58.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 289
Related reactions
1 records
Compound notes
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