HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 67081834Generated: October 23, 2026
3,5-Dichloro-4-isopropoxybenzoic acid
3,5-Dichloro-4-isopropoxybenzoic acid · 3,5-Dichloro-4-propan-2-yloxybenzoic acid · Benzoic acid, 3,5-dichloro-4-(1-methylethoxy)-
https://huagongshe.com/en/chemical/67081834
Identifiers & Physical Properties
| CAS No. | 41490-10-2 |
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| Molecular formula | C10H10Cl2O3 |
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| Average molar mass | 249.09 g/mol |
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| Monoisotopic mass | 248.00069954 g/mol |
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| SMILES | CC(C)Oc1c(Cl)cc(C(=O)O)cc1Cl |
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| InChIKey | PSZCPQCRWUJQFK-UHFFFAOYSA-N |
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| PubChem CID | 67081834 |
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| DTXSID | DTXSID70736389 |
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Chemical & Physical Properties
| XLogP | 3.7 |
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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 | 3 |
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| Heavy atoms | 15 |
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| Formal charge | 0 |
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| Complexity | 221 |
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| Boiling point | 346.3±37.0 °C(Predicted) |
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| Density | 1.359±0.06 g/cm3(Predicted) |
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| Storage conditions | Store at Room Tem. |
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| pKa (acidity coefficient) | 3.91±0.10(Predicted) |
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| GHS pictogram | GHS07 |
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| Signal word | Warning |
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| GHS hazard statements | H315-H319 |
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| GHS precautionary statements | P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313 |
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Safety & Regulations
| Signal word | Warning |
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| GHS pictogram | GHS07 |
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| GHS hazard statements | H315-H319 |
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| GHS precautionary statements | P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313 |
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