HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 66758131Generated: November 3, 2026
1-(4-Chloro-phenyl)-piperazine-2-carboxylic acid methyl ester
https://huagongshe.com/en/chemical/66758131
Identifiers & Physical Properties
| Molecular formula | C12H15ClN2O2 |
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| Average molar mass | 254.71 g/mol |
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| Monoisotopic mass | 254.0822054 g/mol |
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| SMILES | COC(=O)C1CNCCN1c1ccc(Cl)cc1 |
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| InChIKey | HQVHKRDDSGIICQ-UHFFFAOYSA-N |
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| PubChem CID | 66758131 |
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Chemical & Physical Properties
| XLogP | 2 |
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| Topological polar surface area | 41.6 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 4 |
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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 | 267 |
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