HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 452913Generated: November 3, 2026
2,4(1H,3H)-Pyrimidinedione, 6-ethynyl-1-((2-hydroxyethoxy)methyl)-5-methyl-
https://huagongshe.com/en/chemical/452913
Identifiers & Physical Properties
| CAS No. | 125056-89-5 |
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| Molecular formula | C10H12N2O4 |
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| Average molar mass | 224.21 g/mol |
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| Monoisotopic mass | 224.07970687 g/mol |
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| SMILES | C#Cc1c(C)c(=O)[nH]c(=O)n1COCCO |
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| InChIKey | PLMDRSHIPAEVJO-UHFFFAOYSA-N |
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| PubChem CID | 452913 |
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| ChEMBL | CHEMBL120888 |
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| DTXSID | DTXSID80154611 |
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Chemical & Physical Properties
| XLogP | -0.9 |
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| Topological polar surface area | 78.9 |
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| Hydrogen bond donors | 2 |
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| Hydrogen bond acceptors | 4 |
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| Rotatable bonds | 5 |
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| Heavy atoms | 16 |
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| Formal charge | 0 |
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| Complexity | 391 |
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