Basic information
- CAS
4740-86-7- Standard SMILES
Cc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)n1- InChIKey
DBBXSRDCSJOTDU-UHFFFAOYSA-N- Molecular formula
- C12H10Cl2N2O
- Average molar mass
- 269.12 g/mol
- Monoisotopic mass
- 268.0170183
Names & identifiers
- Preferred name
- Zinc00092341
- IUPAC
- 2-[(3,4-dichlorophenyl)methyl]-6-methylpyridazin-3-one
Names & synonyms
4740-86-7ZINC00092341DTXSID80384133RefChem:388641DTXCID503351572-[(3,4-dichlorophenyl)methyl]-6-methylpyridazin-3-oneMaybridge1_001895HMS546O03BTB 06989CCG-2363832-[(3,4-Dichlorophenyl)methyl]-6-methylpyridazin-3(2H)-one
Database identifiers
- CAS
4740-86-7- PubChem CID
- 2800007
- DTXSID
DTXSID80384133
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 368
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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