HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 2777089Generated: October 30, 2026
1-[(Methylthio)methyl]piperidine
N-Methylthiomethylpiperidine · 1-[(METHYLTHIO)METHYL]PIPERIDINE · Piperidine, 1-[(methylthio)methyl]-
https://huagongshe.com/en/chemical/2777089
Identifiers & Physical Properties
| CAS No. | 17859-41-5 |
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| Molecular formula | C7H15NS |
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| Average molar mass | 145.27 g/mol |
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| Monoisotopic mass | 145.09252066 g/mol |
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| SMILES | CSCN1CCCCC1 |
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| InChIKey | WBGBLGWWFQCJAI-UHFFFAOYSA-N |
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| PubChem CID | 2777089 |
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| DTXSID | DTXSID20380371 |
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Chemical & Physical Properties
| XLogP | 1.9 |
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| Topological polar surface area | 28.5 |
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| Hydrogen bond donors | 0 |
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| Hydrogen bond acceptors | 2 |
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| Rotatable bonds | 2 |
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| Heavy atoms | 9 |
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| Formal charge | 0 |
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| Complexity | 69.3 |
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| Boiling point | 92 °C |
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| Density | 0.974±0.06 g/cm3(Predicted) |
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| pKa (acidity coefficient) | 8.36±0.10(Predicted) |
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| GHS pictogram | GHS05,GHS07 |
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| Signal word | Danger |
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| GHS hazard statements | H302+H312+H332-H315-H318-H335 |
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| GHS precautionary statements | P260-P280-P301+P312-P302+P352-P304+P340-P361+P364 |
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| Customs code | 2933399990 |
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Safety & Regulations
| Customs code | 2933399990 |
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| Signal word | Danger |
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| GHS pictogram | GHS05,GHS07 |
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| GHS hazard statements | H302+H312+H332-H315-H318-H335 |
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| GHS precautionary statements | P260-P280-P301+P312-P302+P352-P304+P340-P361+P364 |
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![1-[(Methylthio)methyl]piperidine molecular structure](/img/chemical/2777089.png)