HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 58950708Generated: October 27, 2026
2-[(4-Chloro-benzenesulfonyl)-(2,3,6-trifluoro-phenyl)-methyl]-propane-1,3-diol
https://huagongshe.com/en/chemical/58950708
Identifiers & Physical Properties
| Molecular formula | C16H14ClF3O4S |
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| Average molar mass | 394.8 g/mol |
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| SMILES | O=S(=O)(c1ccc(Cl)cc1)C(c1c(F)ccc(F)c1F)C(CO)CO |
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| InChIKey | AZRTUILCMDMPPZ-UHFFFAOYSA-N |
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| PubChem CID | 58950708 |
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Chemical & Physical Properties
| XLogP | 2.5 |
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| Topological polar surface area | 83 |
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| Hydrogen bond donors | 2 |
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| Hydrogen bond acceptors | 7 |
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| Rotatable bonds | 6 |
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| Heavy atoms | 25 |
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| Formal charge | 0 |
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| Complexity | 518 |
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![2-[(4-Chloro-benzenesulfonyl)-(2,3,6-trifluoro-phenyl)-methyl]-propane-1,3-diol molecular structure](/img/chemical/58950708.png)