HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 5354635Generated: November 4, 2026
dimethyl (2E)-2-(1,3-benzodioxol-5-ylmethylidene)butanedioate
https://huagongshe.com/en/chemical/5354635
Identifiers & Physical Properties
| CAS No. | 5447-44-9 |
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| Molecular formula | C14H14O6 |
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| Average molar mass | 278.26 g/mol |
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| Monoisotopic mass | 278.07903816 g/mol |
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| SMILES | COC(=O)C/C(=C\c1ccc2c(c1)OCO2)C(=O)OC |
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| InChIKey | RVLAMCAJDQHBHI-BJMVGYQFSA-N |
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| PubChem CID | 5354635 |
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Chemical & Physical Properties
| XLogP | 1.8 |
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| Topological polar surface area | 71.1 |
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| Hydrogen bond donors | 0 |
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| Hydrogen bond acceptors | 6 |
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| Rotatable bonds | 6 |
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| Heavy atoms | 20 |
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| Formal charge | 0 |
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| Complexity | 402 |
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