Basic information
- Standard SMILES
Oc1ccc(Cl)cc1-c1ccnnc1- InChIKey
BMERCUZCQCVSNY-UHFFFAOYSA-N- Molecular formula
- C10H7ClN2O
- Average molar mass
- 206.63 g/mol
- Monoisotopic mass
- 206.0246905
Names & identifiers
- Preferred name
- 4-Chloro-2-pyridazin-4-ylphenol
- IUPAC
- 4-chloro-2-pyridazin-4-ylphenol
Names & synonyms
1354786-58-5SCHEMBL3219542-pyridazin-4-yl-4-chlorophenol4-Chloro-2-pyridazin-4-ylphenolBMERCUZCQCVSNY-UHFFFAOYSA-NDA-39723
Database identifiers
- PubChem CID
- 136200875
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 46 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 191
Related reactions
2 records
Compound notes
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