| CAS Number | 1493607-33-2 |
| Catalog Number | AG01DVE3 |
| Chemical Name | 1-(1,4-dimethyl-1H-pyrazol-5-yl)ethan-1-one |
| IUPAC Name | 1-(2,4-dimethylpyrazol-3-yl)ethanone |
| InChI | InChI=1S/C7H10N2O/c1-5-4-8-9(3)7(5)6(2)10/h4H,1-3H3 |
| InChI Key | OEYZTQRNRNGHJB-UHFFFAOYSA-N |
| MDL Number | MFCD31617122 |
| Molecular Formula | C7H10N2O |
| Molecular Weight | 138.1671 |
| SMILES | CC(C1N(C)N=CC=1C)=O |
| Synonyms | 1-(1,4-dimethyl-1H-pyrazol-5-yl)ethan-1-one,
1493607-33-2,
|
| Complexity | 147 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 138.079313g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 138.17g/mol |
| Monoisotopic Mass | 138.079313g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 34.9Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
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Lot Number