HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 3071069Generated: November 3, 2026
5,5-Dimethylhexyl 3-amino-3-phenylpropanoate--hydrogen chloride (1/1)
https://huagongshe.com/en/chemical/3071069
Identifiers & Physical Properties
| CAS No. | 87253-00-7 |
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| Molecular formula | C17H28ClNO2 |
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| Average molar mass | 313.9 g/mol |
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| Monoisotopic mass | 313.1808568 g/mol |
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| SMILES | CC(C)(C)CCCCOC(=O)CC(N)c1ccccc1.Cl |
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| InChIKey | UVSRNRGXQOJPOW-UHFFFAOYSA-N |
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| PubChem CID | 3071069 |
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| DTXSID | DTXSID001007453 |
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Chemical & Physical Properties
| Topological polar surface area | 52.3 |
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| Hydrogen bond donors | 2 |
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| Hydrogen bond acceptors | 3 |
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| Rotatable bonds | 9 |
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| Heavy atoms | 21 |
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| Formal charge | 0 |
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| Complexity | 277 |
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