HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 213968Generated: November 4, 2026
1H-Azepine, hexahydro-1-(1-methyl-2-phenylethyl)-, hydrochloride
https://huagongshe.com/en/chemical/213968
Identifiers & Physical Properties
| CAS No. | 27431-98-7 |
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| Molecular formula | C15H24ClN |
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| Average molar mass | 253.81 g/mol |
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| Monoisotopic mass | 253.1597275 g/mol |
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| SMILES | CC(Cc1ccccc1)N1CCCCCC1.Cl |
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| InChIKey | LBBBUXHHFSIFNO-UHFFFAOYSA-N |
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| PubChem CID | 213968 |
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| DTXSID | DTXSID60950113 |
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Chemical & Physical Properties
| Topological polar surface area | 3.2 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 1 |
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| Rotatable bonds | 3 |
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| Heavy atoms | 17 |
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| Formal charge | 0 |
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| Complexity | 176 |
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