HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 59639Generated: November 4, 2026
3-Aza-9-azoniabicyclo(3.3.1)nonane, 9,9-dimethyl-3-(3-(1-methylpiperidinio)propyl)-, diiodide
https://huagongshe.com/en/chemical/59639
Identifiers & Physical Properties
| CAS No. | 102585-74-0 |
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| Molecular formula | C18H37I2N3 |
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| Average molar mass | 549.3 g/mol |
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| Monoisotopic mass | 549.10769 g/mol |
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| SMILES | C[N+]1(CCCN2CC3CCCC(C2)[N+]3(C)C)CCCCC1.[I-].[I-] |
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| InChIKey | CNQOESYEBAIYHH-UHFFFAOYSA-L |
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| PubChem CID | 59639 |
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| DTXSID | DTXSID30907876 |
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Chemical & Physical Properties
| Topological polar surface area | 3.2 |
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| Hydrogen bond donors | 0 |
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| Hydrogen bond acceptors | 3 |
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| Rotatable bonds | 4 |
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| Heavy atoms | 23 |
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| Formal charge | 0 |
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| Complexity | 330 |
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