HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 210607Generated: November 4, 2026
Methyl (1,1-dioxo-2,3-dihydro-1H-1lambda~6~,2-benzothiazol-3-yl)acetate
https://huagongshe.com/en/chemical/210607
Identifiers & Physical Properties
| CAS No. | 21416-93-3 |
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| Molecular formula | C10H11NO4S |
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| Average molar mass | 241.27 g/mol |
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| Monoisotopic mass | 241.04087901 g/mol |
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| SMILES | COC(=O)CC1NS(=O)(=O)c2ccccc21 |
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| InChIKey | RCLRCEOXSRMFPJ-UHFFFAOYSA-N |
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| PubChem CID | 210607 |
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| DTXSID | DTXSID80943981 |
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Chemical & Physical Properties
| XLogP | 0.3 |
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| Topological polar surface area | 80.9 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 5 |
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| Rotatable bonds | 3 |
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| Heavy atoms | 16 |
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| Formal charge | 0 |
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| Complexity | 373 |
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