1-(Pyrimidin-4-yl)ethanone
1-pyrimidin-4-ylethanone
Also Known As: 1-(Pyrimidin-4-yl)ethanone|4-Acetylpyrimidine|1-pyrimidin-4-ylethanone|1-Pyrimidin-4-yl-ethanone|4-acetyl pyrimidine|Ethanone,1-(4-pyrimidinyl)-|methyl 4-pyrimidyl ketone|Ethanone, 1-(4-pyrimidinyl)-|1-(PYRIMIDIN-4-YL)ETHAN-1-ONE|1-(4-Pyrimidinyl)ethanone|methyl 4-pyrimidinyl ketone|1-(4-Pyrimidinyl)ethanone #|KS-00000I7Z|2,3-Dibromo-6,7-dicyanonaphthalene|Ethanone, 1-(4-pyrimidinyl)- (9CI)|1-?(pyrimidin-?4-?yl)?ethan-?1-?one|4CH-002072
CAS: 40163-56-2
| Molecular Formula | C6H6N2O |
|---|---|
| Molecular Weight | 122.04801 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 42.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 122.04801 |
| Monoisotopic Mass | 122.04801 |
| Heavy Atoms | 9 |
| Complexity | 114.0 |
Chemical Identifiers
| CAS Number | 40163-56-2 |
|---|---|
| SMILES | CC(=O)C1=NC=NC=C1 |
| InChIKey | UZKADDSUUBRMKO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Food Additives (3 patents)
Heterocyclic Building Blocks (42 patents)
Pharmaceutical Intermediates (36 patents)
Product Overview
1-(Pyrimidin-4-yl)ethanone (CAS 40163-56-2), with molecular formula C6H6N2O and molecular weight 122.04801 g/mol. IUPAC: 1-pyrimidin-4-ylethanone.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
Frequently Asked Questions
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