7-Chloro-4-nitroquinoline
Basic information
- CAS
1076199-85-3- Standard SMILES
O=[N+]([O-])c1ccnc2cc(Cl)ccc12- InChIKey
DNMLUVBXPFQOKB-UHFFFAOYSA-N- Molecular formula
- C9H5ClN2O2
- Average molar mass
- 208.6 g/mol
- Monoisotopic mass
- 208.0039551
Names & identifiers
- Preferred name
- 7-Chloro-4-nitroquinoline
- IUPAC
- 7-chloro-4-nitroquinoline
- English name
- 7-Chloro-4-nitroquinoline
- Molecular formula
- C9H5ClN2O2
- Molecular weight
- 208.6012
Names & synonyms
7-CHLORO-4-NITROQUINOLINE1076199-85-3DTXSID80652521AKOS027446569DB-307322
Database identifiers
- CAS
1076199-85-3- PubChem CID
- 29976142
- DTXSID
DTXSID80652521
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 58.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 231
Physicochemical properties
- Melting point
- 88 · 88-90°C
- storage temp.
- -20 °C · -20°C Freezer, Under Inert Atmosphere
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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