Identifiers & Physical Properties
| CAS No. | 14213-97-9 |
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| Molecular formula | BO3-3 |
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| Average molar mass | 58.81 g/mol |
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| Monoisotopic mass | 58.995695 g/mol |
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| SMILES | [O-]B([O-])[O-] |
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| InChIKey | BTBUEUYNUDRHOZ-UHFFFAOYSA-N |
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| PubChem CID | 26574 |
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| ChEMBL | CHEMBL3833411 |
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| ChEBI | CHEBI:22908 |
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| DTXSID | DTXSID20931362 |
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Chemical & Physical Properties
| Topological polar surface area | 69.2 |
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| Hydrogen bond donors | 0 |
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| Hydrogen bond acceptors | 3 |
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| Rotatable bonds | 0 |
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| Heavy atoms | 4 |
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| Formal charge | -3 |
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| Complexity | 8 |
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Safety & Regulations
| Protective Action Criteria (PAC) | 6.0 [mg/m3]21 [mg/m3]130 [mg/m3] |
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