Basic information
- Standard SMILES
Cc1ncnc(O)c1Cl- InChIKey
YIDUVRHFPFLCLN-UHFFFAOYSA-N- Molecular formula
- C5H5ClN2O
- Average molar mass
- 144.56 g/mol
- Monoisotopic mass
- 144.0090405
Names & identifiers
- IUPAC
- 5-chloro-6-methyl-1H-pyrimidin-4-one
Database identifiers
- PubChem CID
- 588891
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 41.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 207
Related reactions
3 records
Linked notes
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