Basic information
- Standard SMILES
O=CCCc1cc(-c2ccccc2)n(-c2ccccc2)n1- InChIKey
LKFSMBISLFRLEA-UHFFFAOYSA-N- Molecular formula
- C18H16N2O
- Average molar mass
- 276.3 g/mol
- Monoisotopic mass
- 276.12626314
Names & identifiers
- Preferred name
- 3-(1,5-diphenyl-1H-pyrazol-3-yl)propanal
- IUPAC
- 3-(1,5-diphenylpyrazol-3-yl)propanal
Names & synonyms
SCHEMBL3236667LKFSMBISLFRLEA-UHFFFAOYSA-N3-(1,5-diphenyl-1H-pyrazol-3-yl)propanal
Database identifiers
- PubChem CID
- 42631135
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 34.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 321
Related reactions
29 records
Compound notes
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