HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 45791108Generated: October 28, 2026
1-(2-Methoxyethyl)-6-oxopiperidine-3-carboxylic acid
CHEMBRDG-BB 4015798 · 1-(2-METHOXYETHYL)-6-OXOPIPERIDINE-3-CARBOXYLIC ACID · 3-Piperidinecarboxylic acid, 1-(2-methoxyethyl)-6-oxo- · 1-(2-methoxyethyl)-6-oxopiperidine-3-carboxylic acid(SALTDATA: FREE)
https://huagongshe.com/en/chemical/45791108
Identifiers & Physical Properties
| CAS No. | 915920-08-0 |
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| Molecular formula | C9H15NO4 |
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| Average molar mass | 201.22 g/mol |
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| Monoisotopic mass | 201.10010796 g/mol |
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| SMILES | COCCN1CC(C(=O)O)CCC1=O |
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| InChIKey | FVGPDAWXQBRLSV-UHFFFAOYSA-N |
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| PubChem CID | 45791108 |
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| DTXSID | DTXSID50672418 |
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Chemical & Physical Properties
| XLogP | -0.8 |
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| Topological polar surface area | 66.8 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 4 |
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| Rotatable bonds | 4 |
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| Heavy atoms | 14 |
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| Formal charge | 0 |
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| Complexity | 229 |
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| Boiling point | 399.7±37.0 °C(Predicted) |
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| Density | 1+-.0.06 g/cm3(Predicted) |
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| Physical state | solid |
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| pKa (acidity coefficient) | 4.22±0.20(Predicted) |
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| InChI | 1S/C9H15NO4/c1-14-5-4-10-6-7(9(12)13)2-3-8(10)11/h7H,2-6H2,1H3,(H,12,13) |
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| InChIKey | FVGPDAWXQBRLSV-UHFFFAOYSA-N |
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| SMILES | O=C1N(CCOC)CC(CC1)C(O)=O |
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| UNSPSC Code | 12352200 |
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| GHS pictogram | GHS05,GHS07 |
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| Signal word | Danger |
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| GHS hazard statements | H302-H318 |
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| GHS precautionary statements | P280-P305+P351+P338 |
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| Hazard symbols | Xn |
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| Risk statements (R) | 22-41 |
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| Safety statements (S) | 26-39 |
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| Water hazard class (WGK) | WGK 3 |
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| Storage class | 13 - Non Combustible Solids |
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| Hazard class | Acute Tox. 4 OralEye Dam. 1 |
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Safety & Regulations
| Water hazard class (WGK) | WGK 3 |
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| Risk statements (R) | 22-41 |
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| Signal word | Danger |
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| GHS pictogram | GHS05,GHS07 |
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| Hazard symbols | Xn |
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| Safety statements (S) | 26-39 |
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| Storage class | 13 - Non Combustible Solids |
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| GHS hazard statements | H302-H318 |
|---|
| Hazard class | Acute Tox. 4 OralEye Dam. 1 |
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| GHS precautionary statements | P280-P305+P351+P338 |
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