2-Ethylcyclohexanone
2-Ethylcyclohexanone structure
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Common Name | 2-Ethylcyclohexanone | ||
|---|---|---|---|---|
| CAS Number | 4423-94-3 | Molecular Weight | 126.19600 | |
| Density | 0.898g/cm3 | Boiling Point | 184.7ºC at 760mmHg | |
| Molecular Formula | C8H14O | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 58.5ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2-Ethylcyclohexanone |
|---|---|
| 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 | 0.898g/cm3 |
|---|---|
| Boiling Point | 184.7ºC at 760mmHg |
| Molecular Formula | C8H14O |
| Molecular Weight | 126.19600 |
| Flash Point | 58.5ºC |
| Exact Mass | 126.10400 |
| PSA | 17.07000 |
| LogP | 2.15570 |
| Index of Refraction | 1.441 |
| InChIKey | WKYYYUWKFPFVEY-UHFFFAOYSA-N |
| SMILES | CCC1CCCCC1=O |
| Water Solubility | Soluble in alcohol. Insoluble in water. |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Safety Phrases | S23-S24/25 |
|---|---|
| HS Code | 2914299000 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2914299000 |
|---|---|
| Summary | 2914299000. other cyclanic, cyclenic or cyclotherpenic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Effective dose required for anticonvulsant activity against pentylenetetrazole-induce...
Source: ChEMBL
Target: Mus musculus
External Id: CHEMBL720900
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Name: Toxic dose at which 50 percent of the mice failed the rotarod toxicity test
Source: ChEMBL
Target: Mus musculus
External Id: CHEMBL733466
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 2-ethylcyclohexan-1-one |
| MFCD00066306 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the English name of 2-Ethylcyclohexanone? |
| A: The English name of 2-Ethylcyclohexanone is 2-Ethylcyclohexanone. |
| Q: What is the SMILES notation of 2-Ethylcyclohexanone? |
| A: SMILES notation of 2-Ethylcyclohexanone is CCC1CCCCC1=O. |
| Q: How is the water solubility of 2-Ethylcyclohexanone? |
| A: Water solubility of 2-Ethylcyclohexanone: Soluble in alcohol. Insoluble in water. |
| Q: What is the safety information for 2-Ethylcyclohexanone? |
| A: Safety information for 2-Ethylcyclohexanone: S23-S24/25. |
| Q: What is the LogP of 2-Ethylcyclohexanone? |
| A: LogP of 2-Ethylcyclohexanone is 2.15570. |
| Q: What is the boiling point of 2-Ethylcyclohexanone? |
| A: Boiling point of 2-Ethylcyclohexanone is 184.7ºC at 760mmHg. |
| Q: What is the molecular formula of 2-Ethylcyclohexanone? |
| A: Molecular formula of 2-Ethylcyclohexanone is C8H14O. |
| Q: What is the polar surface area (PSA) of 2-Ethylcyclohexanone? |
| A: Polar surface area (PSA) of 2-Ethylcyclohexanone is 17.07000. |
| Q: What is the molecular weight of 2-Ethylcyclohexanone? |
| A: Molecular weight of 2-Ethylcyclohexanone is 126.19600. |
| Q: What is the InChIKey of 2-Ethylcyclohexanone? |
| A: InChIKey of 2-Ethylcyclohexanone is WKYYYUWKFPFVEY-UHFFFAOYSA-N. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |