HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 136138564Generated: October 29, 2026
2-[1-(Ethoxyimino)propyl]-3-hydroxy-5-(benzo[b]thien-4-yl)cyclohex-2-en-1-one
https://huagongshe.com/en/chemical/136138564
Identifiers & Physical Properties
| Molecular formula | C19H21NO3S |
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| Average molar mass | 343.4 g/mol |
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| Monoisotopic mass | 343.12421471 g/mol |
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| SMILES | CCON=C(CC)C1=C(O)CC(c2cccc3sccc23)CC1=O |
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| InChIKey | AQTNTNZVKKQBHE-UHFFFAOYSA-N |
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| PubChem CID | 136138564 |
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Chemical & Physical Properties
| XLogP | 4 |
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| Topological polar surface area | 87.1 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 5 |
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| Rotatable bonds | 5 |
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| Heavy atoms | 24 |
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| Formal charge | 0 |
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| Complexity | 543 |
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![2-[1-(Ethoxyimino)propyl]-3-hydroxy-5-(benzo[b]thien-4-yl)cyclohex-2-en-1-one molecular structure](/img/chemical/136138564.png)