HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 16123765Generated: October 25, 2026
[3-{2-Chloro-4-[(3-fluorobenzyl)sulfonyl]phenoxy}-5-(trifluoromethyl)phenyl]acetic acid
https://huagongshe.com/en/chemical/16123765
Identifiers & Physical Properties
| Molecular formula | C22H15ClF4O5S |
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| Average molar mass | 502.9 g/mol |
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| Monoisotopic mass | 502.0264851 g/mol |
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| SMILES | O=C(O)Cc1cc(Oc2ccc(S(=O)(=O)Cc3cccc(F)c3)cc2Cl)cc(C(F)(F)F)c1 |
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| InChIKey | ZGUIAOZRRTXVIG-UHFFFAOYSA-N |
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| PubChem CID | 16123765 |
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Chemical & Physical Properties
| XLogP | 5.3 |
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| Topological polar surface area | 89.1 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 9 |
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| Rotatable bonds | 7 |
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| Heavy atoms | 33 |
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| Formal charge | 0 |
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| Complexity | 772 |
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![[3-{2-Chloro-4-[(3-fluorobenzyl)sulfonyl]phenoxy}-5-(trifluoromethyl)phenyl]acetic acid molecular structure](/img/chemical/16123765.png)