HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 67006383Generated: October 25, 2026
(2R,3S)-2-(3-chloro-4-cyano-2-ethylphenylamino)-3-hydroxybutanoic acid
https://huagongshe.com/en/chemical/67006383
Identifiers & Physical Properties
| Molecular formula | C13H15ClN2O3 |
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| Average molar mass | 282.72 g/mol |
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| Monoisotopic mass | 282.07712 g/mol |
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| SMILES | CCc1c(N[C@@H](C(=O)O)[C@H](C)O)ccc(C#N)c1Cl |
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| InChIKey | DWGVUUPWHIKPSU-JVXZTZIISA-N |
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| PubChem CID | 67006383 |
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Chemical & Physical Properties
| XLogP | 2.4 |
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| Topological polar surface area | 93.4 |
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| Hydrogen bond donors | 3 |
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| Hydrogen bond acceptors | 5 |
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| Rotatable bonds | 5 |
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| Heavy atoms | 19 |
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| Formal charge | 0 |
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| Complexity | 368 |
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