6-Chloro-4-(1-chloro-2-methylpropan-2-yl)-2H-pyridazin-3-one
Basic information
- CAS
117144-78-2- Standard SMILES
CC(C)(CCl)c1cc(Cl)n[nH]c1=O- InChIKey
BIIMJNQYRVWGAQ-UHFFFAOYSA-N- Molecular formula
- C8H10Cl2N2O
- Average molar mass
- 221.08 g/mol
- Monoisotopic mass
- 220.0170183
Names & identifiers
- Preferred name
- 6-Chloro-4-(1-chloro-2-methylpropan-2-yl)-2H-pyridazin-3-one
- IUPAC
- 3-chloro-5-(1-chloro-2-methylpropan-2-yl)-1H-pyridazin-6-one
Names & synonyms
117144-78-26-Chloro-4-(1-chloro-2-methylpropan-2-yl)-2H-pyridazin-3-one6-chloro-4-(1-chloro-2-methylpropan-2-yl)pyridazin-3(2h)-one3-chloro-5-(1-chloro-2-methylpropan-2-yl)-1H-pyridazin-6-oneDTXSID70151710
Database identifiers
- CAS
117144-78-2- PubChem CID
- 189472
- DTXSID
DTXSID70151710
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 41.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 295
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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