4-(2-Chloro-5-pyridylmethyloxy)nitrobenzene
Basic information
- Standard SMILES
O=[N+]([O-])c1ccc(OCc2ccc(Cl)nc2)cc1- InChIKey
JLTHAEURAVLZDV-UHFFFAOYSA-N- Molecular formula
- C12H9ClN2O3
- Average molar mass
- 264.66 g/mol
Names & identifiers
- Preferred name
- 4-(2-Chloro-5-pyridylmethyloxy)nitrobenzene
- IUPAC
- 2-chloro-5-[(4-nitrophenoxy)methyl]pyridine
Names & synonyms
SCHEMBL11238714JLTHAEURAVLZDV-UHFFFAOYSA-NAKOS0001523532-chloro-5-(4-nitrophenoxy) methylpyridine4-(2-chloro-5-pyridylmethyloxy)nitrobenzene
Database identifiers
- PubChem CID
- 20537915
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 67.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 277
Related reactions
3 records
Compound notes
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