HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 11368671Generated: October 30, 2026
4-Pyridinol, 2-(1,1-dimethylethyl)-3-methoxy-6-(trifluoromethyl)-
https://huagongshe.com/en/chemical/11368671
Identifiers & Physical Properties
| CAS No. | 791104-13-7 |
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| Molecular formula | C11H14F3NO2 |
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| Average molar mass | 249.23 g/mol |
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| Monoisotopic mass | 249.09766318 g/mol |
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| SMILES | COc1c(C(C)(C)C)[nH]c(C(F)(F)F)cc1=O |
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| InChIKey | SEZALVMBFBLABT-UHFFFAOYSA-N |
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| PubChem CID | 11368671 |
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| DTXSID | DTXSID40463791 |
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Chemical & Physical Properties
| XLogP | 2.9 |
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| Topological polar surface area | 38.3 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 6 |
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| Rotatable bonds | 2 |
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| Heavy atoms | 17 |
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| Formal charge | 0 |
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| Complexity | 400 |
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