HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 18314576Generated: October 23, 2026
Ethyl 4-[(7,8-dihydro-5-hydroxy-8,8-dimethyl-5-carboethoxymethylnaphth-2-yl)ethynyl]benzoate
https://huagongshe.com/en/chemical/18314576
Identifiers & Physical Properties
| Molecular formula | C27H30O5 |
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| Average molar mass | 434.5 g/mol |
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| SMILES | CCOC(=O)CC1(O)CCC(C)(C)c2cc(C#Cc3ccc(C(=O)OCC)cc3)ccc21 |
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| InChIKey | XFOPKHFTGFAQES-UHFFFAOYSA-N |
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| PubChem CID | 18314576 |
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Chemical & Physical Properties
| XLogP | 5.5 |
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| Topological polar surface area | 72.8 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 5 |
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| Rotatable bonds | 9 |
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| Heavy atoms | 32 |
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| Formal charge | 0 |
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| Complexity | 736 |
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![Ethyl 4-[(7,8-dihydro-5-hydroxy-8,8-dimethyl-5-carboethoxymethylnaphth-2-yl)ethynyl]benzoate molecular structure](/img/chemical/18314576.png)