Basic information
- CAS
902750-01-0- Standard SMILES
COc1cnnc(Cl)c1C#N- InChIKey
KFHJLWSKBLOCNS-UHFFFAOYSA-N- Molecular formula
- C6H4ClN3O
- Average molar mass
- 169.57 g/mol
- Monoisotopic mass
- 169.0042895
Names & identifiers
- Preferred name
- 3-Chloro-5-methoxypyridazine-4-carbonitrile
- IUPAC
- 3-chloro-5-methoxypyridazine-4-carbonitrile
- English name
- 3-Chloro-5-methoxy-4-pyridazinecarbonitrile
- Molecular formula
- C6H4ClN3O
- Molecular weight
- 0
Names & synonyms
902750-01-03-CHLORO-5-METHOXY-4-PYRIDAZINECARBONITRILE3-chloro-5-methoxypyridazine-4-carbonitrileSCHEMBL8236411DTXSID30702121AKOS0063145903-CHLORO-5-METHOXY-PYRIDAZINE-4-CARBONITRILE
Database identifiers
- CAS
902750-01-0- PubChem CID
- 53439733
- DTXSID
DTXSID30702121
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 58.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 178
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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