HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 15744116Generated: November 1, 2026
2-(4-Bromophenoxy)butanoic acid
AKOS B013883 · ART-CHEM-BB B013883 · 2-(4-Bromophenoxy)butanoic acid · Butanoic acid, 2-(4-bromophenoxy)-
https://huagongshe.com/en/chemical/15744116
Identifiers & Physical Properties
| CAS No. | 143094-65-9 |
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| Molecular formula | C10H11BrO3 |
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| Average molar mass | 259.1 g/mol |
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| Monoisotopic mass | 257.98916 g/mol |
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| SMILES | CCC(Oc1ccc(Br)cc1)C(=O)O |
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| InChIKey | SOOHCBKDVIPIIJ-UHFFFAOYSA-N |
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| PubChem CID | 15744116 |
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| DTXSID | DTXSID201303261 |
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Chemical & Physical Properties
| XLogP | 3.1 |
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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 | 4 |
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| Heavy atoms | 14 |
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| Formal charge | 0 |
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| Complexity | 188 |
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| Boiling point | 351.8±17.0 °C(Predicted) |
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| Density | 1.487±0.06 g/cm3(Predicted) |
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| pKa (acidity coefficient) | 3.14±0.10(Predicted) |
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| Hazard symbols | Xi |
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| Hazard class | IRRITANT |
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Safety & Regulations
| Hazard symbols | Xi |
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| Hazard class | IRRITANT |
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