HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 106901Generated: October 30, 2026
Methanone, (4-((3,4-dimethylhexyl)oxy)-2-hydroxyphenyl)phenyl-
Einecs 267-348-5 · [4-[(3,4-dimethylhexyl)oxy]-2-hydroxyphenyl] phenyl ketone · Methanone, (4-((3,4-dimethylhexyl)oxy)-2-hydroxyphenyl)phenyl-
https://huagongshe.com/en/chemical/106901
Identifiers & Physical Properties
| CAS No. | 67845-98-1 |
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| Molecular formula | C21H26O3 |
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| Average molar mass | 326.4 g/mol |
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| Monoisotopic mass | 326.18819469 g/mol |
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| SMILES | CCC(C)C(C)CCOc1ccc(C(=O)c2ccccc2)c(O)c1 |
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| InChIKey | VJDDEOYUJPSXDO-UHFFFAOYSA-N |
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| PubChem CID | 106901 |
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| EC No. | 267-348-5 |
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| DTXSID | DTXSID70886954 |
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Chemical & Physical Properties
| XLogP | 6.5 |
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| Topological polar surface area | 46.5 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 3 |
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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 | 375 |
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| Endocrine Disruptors | Potential endocrine disrupting compound |
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| EPA Substance Registry System | Methanone, [4-[(3,4-dimethylhexyl)oxy]-2-hydroxyphenyl]phenyl- (67845-98-1) |
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| TSCA inventory status | TSCA listed |
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Safety & Regulations
| TSCA inventory status | TSCA listed |
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