HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 228749Generated: October 23, 2026
Benzyl piperidine-1-carboxylate
1-Z-Piperidine · benzyl piperidine-1-carboxylate · 1-Piperidinecarboxylic acid, phenylmethyl ester
https://huagongshe.com/en/chemical/228749
Identifiers & Physical Properties
| CAS No. | 3742-91-4 |
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| Molecular formula | C13H17NO2 |
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| Average molar mass | 219.28 g/mol |
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| Monoisotopic mass | 219.12592879 g/mol |
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| SMILES | O=C(OCc1ccccc1)N1CCCCC1 |
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| InChIKey | TUWZZXGAUMSUOB-UHFFFAOYSA-N |
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| PubChem CID | 228749 |
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| DTXSID | DTXSID00281514 |
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Chemical & Physical Properties
| XLogP | 2.5 |
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| Topological polar surface area | 29.5 |
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| Hydrogen bond donors | 0 |
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| Hydrogen bond acceptors | 2 |
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| Rotatable bonds | 3 |
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| Heavy atoms | 16 |
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| Formal charge | 0 |
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| Complexity | 218 |
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| Boiling point | 129-131 °C(Press: 0.5 Torr) |
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| Density | 1.119±0.06 g/cm3(Predicted) |
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| pKa (acidity coefficient) | -1.33±0.20(Predicted) |
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| GHS pictogram | GHS07 |
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| Signal word | Warning |
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| GHS hazard statements | H302-H315-H319-H335 |
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| GHS precautionary statements | P280-P305+P351+P338 |
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Safety & Regulations
| Signal word | Warning |
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| GHS pictogram | GHS07 |
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| GHS hazard statements | H302-H315-H319-H335 |
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| GHS precautionary statements | P280-P305+P351+P338 |
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