3-Pyrazolin-5-one, 3-butoxy-1,2-diphenyl-
Basic information
- CAS
37585-41-4- Standard SMILES
CCCCOc1cc(=O)n(-c2ccccc2)n1-c1ccccc1- InChIKey
UJNOIICZZTWLNC-UHFFFAOYSA-N- Molecular formula
- C19H20N2O2
- Average molar mass
- 308.4 g/mol
- Monoisotopic mass
- 308.15247789
Names & identifiers
- Preferred name
- 3-Pyrazolin-5-one, 3-butoxy-1,2-diphenyl-
- IUPAC
- 5-butoxy-1,2-diphenylpyrazol-3-one
- English name
- 5-butoxy-1,2-diphenyl-pyrazol-3-one
- Molecular formula
- C19H20N2O2
- Molecular weight
- 0
Names & synonyms
37585-41-43-Pyrazolin-5-one, 3-butoxy-1,2-diphenyl-5-butoxy-1,2-diphenyl-1H-pyrazol-3(2H)-oneBRN 06842843-Butoxy-1,2-diphenyl-3-pyrazolin-5-one3-Butoxy-1,2-diphenyl-5-pyrazolone5-butoxy-1,2-diphenyl-1,2-dihydro-3h-pyrazol-3-one3H-Pyrazol-3-one, 5-butoxy-1,2-dihydro-1,2-diphenyl-DTXSID701910155-butoxy-1,2-diphenyl-pyrazol-3-one
Database identifiers
- CAS
37585-41-4- PubChem CID
- 216671
- DTXSID
DTXSID70191015- Nikkaji
- J78.759K
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 32.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 423
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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