HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 215213Generated: November 3, 2026
Benzoic acid, 3-methyl-2-((2,2,4,4-tetramethyl-1-oxopentyl)oxy)-
https://huagongshe.com/en/chemical/215213
Identifiers & Physical Properties
| CAS No. | 35231-88-0 |
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| Molecular formula | C17H24O4 |
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| Average molar mass | 292.4 g/mol |
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| Monoisotopic mass | 292.16745924 g/mol |
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| SMILES | Cc1cccc(C(=O)O)c1OC(=O)C(C)(C)CC(C)(C)C |
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| InChIKey | LIKVLPPQQFOMTB-UHFFFAOYSA-N |
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| PubChem CID | 215213 |
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| DTXSID | DTXSID30188724 |
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Chemical & Physical Properties
| XLogP | 4.5 |
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| Topological polar surface area | 63.6 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 4 |
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| Rotatable bonds | 6 |
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| Heavy atoms | 21 |
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| Formal charge | 0 |
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| Complexity | 392 |
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