HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 12377585Generated: November 3, 2026
Diethyl{[(2-oxo-2H-1-benzopyran-3-yl)amino]methylene}malonate
https://huagongshe.com/en/chemical/12377585
Identifiers & Physical Properties
| Molecular formula | C17H17NO6 |
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| Average molar mass | 331.32 g/mol |
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| Monoisotopic mass | 331.10558726 g/mol |
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| SMILES | CCOC(=O)C(=CNc1cc2ccccc2oc1=O)C(=O)OCC |
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| InChIKey | SKLDXCRATTXTOV-UHFFFAOYSA-N |
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| PubChem CID | 12377585 |
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Chemical & Physical Properties
| XLogP | 3.4 |
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| Topological polar surface area | 90.9 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 7 |
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| Rotatable bonds | 8 |
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| Heavy atoms | 24 |
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| Formal charge | 0 |
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| Complexity | 545 |
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![Diethyl{[(2-oxo-2H-1-benzopyran-3-yl)amino]methylene}malonate molecular structure](/img/chemical/12377585.png)