HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 58950607Generated: October 27, 2026
2-[Hydroxy-(2,3,6-trifluoro-phenyl)-methyl]-malonic Acid Dimethyl Ester
https://huagongshe.com/en/chemical/58950607
Identifiers & Physical Properties
| Molecular formula | C12H11F3O5 |
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| Average molar mass | 292.21 g/mol |
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| Monoisotopic mass | 292.05585793 g/mol |
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| SMILES | COC(=O)C(C(=O)OC)C(O)c1c(F)ccc(F)c1F |
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| InChIKey | WQLMLOSMJUFFDG-UHFFFAOYSA-N |
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| PubChem CID | 58950607 |
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Chemical & Physical Properties
| XLogP | 1.3 |
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| Topological polar surface area | 72.8 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 8 |
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| Rotatable bonds | 6 |
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| Heavy atoms | 20 |
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| Formal charge | 0 |
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| Complexity | 349 |
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![2-[Hydroxy-(2,3,6-trifluoro-phenyl)-methyl]-malonic Acid Dimethyl Ester molecular structure](/img/chemical/58950607.png)