Basic information
- CAS
479481-55-5- Standard SMILES
O=c1[nH]nccc1Cc1ccccc1- InChIKey
GZVJKNAPQDHVHH-UHFFFAOYSA-N- Molecular formula
- C11H10N2O
- Average molar mass
- 186.21 g/mol
- Monoisotopic mass
- 186.07931295
Names & identifiers
- Preferred name
- 4-Benzylpyridazin-3(2H)-one
- IUPAC
- 5-benzyl-1H-pyridazin-6-one
- English name
- 4-Benzyl-3(2H)-pyridazinone
- Molecular formula
- C11H10N2O
- Molecular weight
- 186.21
Names & synonyms
479481-55-54-Benzylpyridazin-3(2H)-oneDTXSID20699218RefChem:290362DTXCID906499674-benzyl-2H-pyridazin-3-onePhenylmethylpyridazonSCHEMBL2342924SCHEMBL5394164GZVJKNAPQDHVHH-UHFFFAOYSA-NAKOS006288266DB-070895
Show more names
4-Benzyl-3(2H)-pyridazinone3(2H)-Pyridazinone, 4-(phenylmethyl)-
Database identifiers
- CAS
479481-55-5- PubChem CID
- 53426432
- DTXSID
DTXSID20699218
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 41.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 275
Chemistry & industry
Suppliers1 total
SMALL-MOL[email protected]
Related reactions
1 records
Compound notes
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