4-[(3-Chloroprop-2-en-1-yl)oxy]-1-methyl-3,5-diphenyl-1H-pyrazole
Basic information
- CAS
60627-67-0- Standard SMILES
Cn1nc(-c2ccccc2)c(OCC=CCl)c1-c1ccccc1- InChIKey
ALCRSVNEBAWDBF-UHFFFAOYSA-N- Molecular formula
- C19H17ClN2O
- Average molar mass
- 324.8 g/mol
- Monoisotopic mass
- 324.1029409
Names & identifiers
- Preferred name
- 4-[(3-Chloroprop-2-en-1-yl)oxy]-1-methyl-3,5-diphenyl-1H-pyrazole
- IUPAC
- 4-(3-chloroprop-2-enoxy)-1-methyl-3,5-diphenylpyrazole
Names & synonyms
60627-67-0DTXSID508218084-[(3-Chloroprop-2-en-1-yl)oxy]-1-methyl-3,5-diphenyl-1H-pyrazole
Database identifiers
- CAS
60627-67-0- PubChem CID
- 71400537
- DTXSID
DTXSID50821808
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 27.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 378
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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