Basic information
- CAS
25832-38-6- Standard SMILES
C=C(C)C(=O)n1nc(C)cc1C- InChIKey
JSNSHSLFWDABHK-UHFFFAOYSA-N- Molecular formula
- C9H12N2O
- Average molar mass
- 164.2 g/mol
- Monoisotopic mass
- 164.09496301
Names & identifiers
- Preferred name
- 1-(3,5-Dimethyl-1H-pyrazol-1-yl)-2-methylprop-2-en-1-one
- IUPAC
- 1-(3,5-dimethylpyrazol-1-yl)-2-methylprop-2-en-1-one
Names & synonyms
25832-38-61-(3,5-Dimethyl-1H-pyrazol-1-yl)-2-methylprop-2-en-1-oneDTXSID60618004RefChem:224085DTXCID20568758SCHEMBL178533521-methacryloyl-3,5-dimethylpyrazole
Database identifiers
- CAS
25832-38-6- PubChem CID
- 21784497
- DTXSID
DTXSID60618004- Nikkaji
- J1.686.666K
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 34.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 213
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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