Basic information
- CAS
1568-14-5- Standard SMILES
O=CN1CCC(c2ccccc2)=N1- InChIKey
UBSOPKLAYPNFFN-UHFFFAOYSA-N- Molecular formula
- C10H10N2O
- Average molar mass
- 174.2 g/mol
- Monoisotopic mass
- 174.07931295
Names & identifiers
- Preferred name
- 3-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde
- IUPAC
- 5-phenyl-3,4-dihydropyrazole-2-carbaldehyde
Names & synonyms
1568-14-53-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehydeSTK066368SCHEMBL27276739DTXSID80397965AKOS0053887631-formyl-4,5-dihydro-3-phenyl-1h pyrazole
Database identifiers
- CAS
1568-14-5- PubChem CID
- 3920786
- DTXSID
DTXSID80397965
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 219
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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