Basic information
- Standard SMILES
CCC(CC)n1cc(Cl)nc(Cl)c1=O- InChIKey
BYQHHSVMKYSMQT-UHFFFAOYSA-N- Molecular formula
- C9H12Cl2N2O
- Average molar mass
- 235.11 g/mol
Names & identifiers
- Preferred name
- 3,5-dichloro-1-(1-ethylpropyl)-2(1H)-pyrazinone
- IUPAC
- 3,5-dichloro-1-pentan-3-ylpyrazin-2-one
Names & synonyms
SCHEMBL4864490BYQHHSVMKYSMQT-UHFFFAOYSA-N3,5-dichloro-1-(1-ethylpropyl)-2(1H)-pyrazinone3,5-dichloro-1-(1-ethylpropyl)-2 (1H)-pyrazinone
Database identifiers
- PubChem CID
- 22004339
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 295
Related reactions
14 records
Compound notes
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