Identifiers & Physical Properties
| CAS No. | 14808-79-8 |
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| Molecular formula | O4S-2 |
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| Average molar mass | 96.07 g/mol |
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| Monoisotopic mass | 95.95282664 g/mol |
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| SMILES | O=S(=O)([O-])[O-] |
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| InChIKey | QAOWNCQODCNURD-UHFFFAOYSA-L |
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| PubChem CID | 1117 |
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| ChEBI | CHEBI:16189 |
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| EC No. | 604-622-9 |
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| DTXSID | DTXSID3042425 |
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Chemical & Physical Properties
| XLogP | -1.5 |
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| Topological polar surface area | 88.6 |
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| Hydrogen bond donors | 0 |
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| Hydrogen bond acceptors | 4 |
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| Rotatable bonds | 0 |
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| Heavy atoms | 5 |
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| Formal charge | -2 |
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| Complexity | 62.2 |
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| Chemical classes | Major ion |
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Safety & Regulations
| Regulatory information | Commission Regulation (EC) No 2229/2004Sulfate: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right. |
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| RAIS Toxicity Values | 0.12CALEPA |
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| USGS Health-Based Screening Levels for Evaluating Water-Quality | Sulfate00945Major ionSmith, C.D. and Nowell, L.H., 2024. Health-Based Screening Levels for evaluating water-quality data (3rd ed.). DOI:10.5066/F71C1TWP |
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