HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 10282995Generated: October 26, 2026
11-[(3Rs,4rs)-7-hydroxy-3-(4-hydroxyphenyl)-3-propylthiochroman-4-yl]-2-(4,4,5,5,5,-pentafluoropentyl)undecanoic acid
https://huagongshe.com/en/chemical/10282995
Identifiers & Physical Properties
| Molecular formula | C34H45F5O4S |
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| Average molar mass | 644.8 g/mol |
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| SMILES | CCCC1(c2ccc(O)cc2)CSc2cc(O)ccc2C1CCCCCCCCCC(CCCC(F)(F)C(F)(F)F)C(=O)O |
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| InChIKey | HRGOODDKYWHEBB-UHFFFAOYSA-N |
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| PubChem CID | 10282995 |
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Chemical & Physical Properties
| XLogP | 11.8 |
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| Topological polar surface area | 103 |
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| Hydrogen bond donors | 3 |
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| Hydrogen bond acceptors | 10 |
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| Rotatable bonds | 18 |
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| Heavy atoms | 44 |
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| Formal charge | 0 |
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| Complexity | 850 |
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![11-[(3Rs,4rs)-7-hydroxy-3-(4-hydroxyphenyl)-3-propylthiochroman-4-yl]-2-(4,4,5,5,5,-pentafluoropentyl)undecanoic acid molecular structure](/img/chemical/10282995.png)