HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 12831703Generated: November 4, 2026
6-amino-N-prop-2-enyl-2,3-dihydro-1,4-benzoxathiine-2-carboxamide
https://huagongshe.com/en/chemical/12831703
Identifiers & Physical Properties
| Molecular formula | C12H14N2O2S |
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| Average molar mass | 250.32 g/mol |
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| Monoisotopic mass | 250.07759887 g/mol |
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| SMILES | C=CCNC(=O)C1CSc2cc(N)ccc2O1 |
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| InChIKey | VDDMATOOOIWTNX-UHFFFAOYSA-N |
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| PubChem CID | 12831703 |
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Chemical & Physical Properties
| XLogP | 1.5 |
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| Topological polar surface area | 89.7 |
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| Hydrogen bond donors | 2 |
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| Hydrogen bond acceptors | 4 |
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| Rotatable bonds | 3 |
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| Heavy atoms | 17 |
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| Formal charge | 0 |
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| Complexity | 298 |
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