1-Methyl-3,5-diphenyl-4-(1-phenylethoxy)-1H-pyrazole
Basic information
- CAS
60627-91-0- Standard SMILES
CC(Oc1c(-c2ccccc2)nn(C)c1-c1ccccc1)c1ccccc1- InChIKey
INGJWBUHJRHOSZ-UHFFFAOYSA-N- Molecular formula
- C24H22N2O
- Average molar mass
- 354.4 g/mol
- Monoisotopic mass
- 354.17321333
Names & identifiers
- Preferred name
- 1-Methyl-3,5-diphenyl-4-(1-phenylethoxy)-1H-pyrazole
- IUPAC
- 1-methyl-3,5-diphenyl-4-(1-phenylethoxy)pyrazole
Names & synonyms
60627-91-01-Methyl-3,5-diphenyl-4-(1-phenylethoxy)-1H-pyrazoleDTXSID70821789
Database identifiers
- CAS
60627-91-0- PubChem CID
- 71400518
- DTXSID
DTXSID70821789
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 27.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 438
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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