Basic information
- CAS
60627-54-5- Standard SMILES
CCCCCCOc1c(-c2ccccc2)nn(C)c1-c1ccccc1- InChIKey
BYDDXBBIHPIEIM-UHFFFAOYSA-N- Molecular formula
- C22H26N2O
- Average molar mass
- 334.5 g/mol
- Monoisotopic mass
- 334.20451346
Names & identifiers
- Preferred name
- 4-(Hexyloxy)-1-methyl-3,5-diphenyl-1H-pyrazole
- IUPAC
- 4-hexoxy-1-methyl-3,5-diphenylpyrazole
Names & synonyms
60627-54-54-(Hexyloxy)-1-methyl-3,5-diphenyl-1H-pyrazoleDTXSID20821815
Database identifiers
- CAS
60627-54-5- PubChem CID
- 71400544
- DTXSID
DTXSID20821815
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 27.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 363
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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