Basic information
- CAS
87963-22-2- Standard SMILES
CC1=NNC(=O)CC1C(O)c1ccccc1- InChIKey
CGBRJTVCEKXLHA-UHFFFAOYSA-N- Molecular formula
- C12H14N2O2
- Average molar mass
- 218.25 g/mol
- Monoisotopic mass
- 218.10552769
Names & identifiers
- Preferred name
- 3(2H)-Pyridazinone, 4,5-dihydro-5-(hydroxyphenylmethyl)-6-methyl-
- IUPAC
- 4-[hydroxy(phenyl)methyl]-3-methyl-4,5-dihydro-1H-pyridazin-6-one
Names & synonyms
87963-22-2DTXSID003266313(2H)-Pyridazinone, 4,5-dihydro-5-(hydroxyphenylmethyl)-6-methyl-RefChem:269536DTXCID90277744NSC6065095-[hydroxy(phenyl)methyl]-6-methyl-4,5-dihydropyridazin-3(2H)-oneNSC-606509
Database identifiers
- CAS
87963-22-2- PubChem CID
- 354514
- DTXSID
DTXSID00326631
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 61.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 295
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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