1-Benzyl-3,5-dimethylpiperidin-4-one
1-Benzyl-3,5-dimethylpiperidin-4-one structure
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Common Name | 1-Benzyl-3,5-dimethylpiperidin-4-one | ||
|---|---|---|---|---|
| CAS Number | 836-21-5 | Molecular Weight | 217.307 | |
| Density | 1.0±0.1 g/cm3 | Boiling Point | 323.0±22.0 °C at 760 mmHg | |
| Molecular Formula | C14H19NO | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 139.6±11.9 °C | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 1-benzyl-3,5-dimethylpiperidin-4-one |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.0±0.1 g/cm3 |
|---|---|
| Boiling Point | 323.0±22.0 °C at 760 mmHg |
| Molecular Formula | C14H19NO |
| Molecular Weight | 217.307 |
| Flash Point | 139.6±11.9 °C |
| Exact Mass | 217.146667 |
| PSA | 20.31000 |
| LogP | 2.17 |
| Vapour Pressure | 0.0±0.7 mmHg at 25°C |
| Index of Refraction | 1.528 |
| InChIKey | KUUYMZATYJQLLZ-UHFFFAOYSA-N |
| SMILES | CC1CN(Cc2ccccc2)CC(C)C1=O |
| Storage condition | 2-8°C |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xi |
|---|---|
| HS Code | 2933399090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~32%
1-Benzyl-3,5-di... CAS#:836-21-5 |
| Literature: MILLENNIUM PHARMACEUTICALS, INC. Patent: WO2004/58709 A1, 2004 ; Location in patent: Page 31; 34 ; WO 2004/058709 A1 |
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~%
1-Benzyl-3,5-di... CAS#:836-21-5 |
| Literature: Kyowa Hakko Kogyo Co., Ltd. Patent: US4639522 A1, 1987 ; |
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~%
1-Benzyl-3,5-di... CAS#:836-21-5 |
| Literature: Vaculik; Kuthan Collection of Czechoslovak Chemical Communications, 1959 , vol. 24, p. 174,176 |
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~%
1-Benzyl-3,5-di... CAS#:836-21-5 |
| Literature: Vaculik; Kuthan Collection of Czechoslovak Chemical Communications, 1959 , vol. 24, p. 174,176 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 4 | |
|---|---|
| DownStream 1 | |
CAS#:104178-93-0This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2933399090 |
|---|---|
| Summary | 2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 1-benzyl-3,5-dimethyl-4-piperidone |
| 1-benzyl-3,5-dimethyl-piperid-4-one |
| 1-Benzyl-3,5-dimethyl-4-piperidinone |
| 1-Benzyl-3,5-dimethyl-piperidin-4-on |
| 1-Benzyl-3,5-dimethyl-piperidin-4-one |
| N-Benzyl-3,5-dimethyl-4-piperidon |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the LogP of 1-benzyl-3,5-dimethylpiperidin-4-one? |
| A: LogP of 1-benzyl-3,5-dimethylpiperidin-4-one is 2.17. |
| Q: What is the SMILES notation of 1-benzyl-3,5-dimethylpiperidin-4-one? |
| A: SMILES notation of 1-benzyl-3,5-dimethylpiperidin-4-one is CC1CN(Cc2ccccc2)CC(C)C1=O. |
| Q: What is the molecular formula of 1-benzyl-3,5-dimethylpiperidin-4-one? |
| A: Molecular formula of 1-benzyl-3,5-dimethylpiperidin-4-one is C14H19NO. |
| Q: What is the InChIKey of 1-benzyl-3,5-dimethylpiperidin-4-one? |
| A: InChIKey of 1-benzyl-3,5-dimethylpiperidin-4-one is KUUYMZATYJQLLZ-UHFFFAOYSA-N. |
| Q: What is the molecular weight of 1-benzyl-3,5-dimethylpiperidin-4-one? |
| A: Molecular weight of 1-benzyl-3,5-dimethylpiperidin-4-one is 217.307. |
| Q: What is the English name of 1-benzyl-3,5-dimethylpiperidin-4-one? |
| A: The English name of 1-benzyl-3,5-dimethylpiperidin-4-one is 1-benzyl-3,5-dimethylpiperidin-4-one. |
| Q: What is the boiling point of 1-benzyl-3,5-dimethylpiperidin-4-one? |
| A: Boiling point of 1-benzyl-3,5-dimethylpiperidin-4-one is 323.0±22.0 °C at 760 mmHg. |
| Q: What are the upstream materials of 1-benzyl-3,5-dimethylpiperidin-4-one? |
| A: Related upstream materials(CAS) of 1-benzyl-3,5-dimethylpiperidin-4-one: 34737-89-8;74-88-4;110331-19-6;42324-07-2. |
| Q: What is the polar surface area (PSA) of 1-benzyl-3,5-dimethylpiperidin-4-one? |
| A: Polar surface area (PSA) of 1-benzyl-3,5-dimethylpiperidin-4-one is 20.31000. |
| Q: What are the storage conditions for 1-benzyl-3,5-dimethylpiperidin-4-one? |
| A: Storage conditions for 1-benzyl-3,5-dimethylpiperidin-4-one: 2-8°C. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |