3-[(2-chlorophenyl)methyl]benzothiazol-2-one
![3-[(2-chlorophenyl)methyl]benzothiazol-2-one Structure](https://image.chemsrc.com/caspic/137/5347-04-6.png)
3-[(2-chlorophenyl)methyl]benzothiazol-2-one structure
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Common Name | 3-[(2-chlorophenyl)methyl]benzothiazol-2-one | ||
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| CAS Number | 5347-04-6 | Molecular Weight | 245.27400 | |
| Density | 1.408g/cm3 | Boiling Point | 443.9ºC at 760 mmHg | |
| Molecular Formula | C14H15NO3 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 222.3ºC | |
Summary: 4,4-Diethyl-1-phenylpyrrolidine-2,3,5-trione (Chinese name: 3-[(2-chlorophenyl)methyl]benzothiazol-2-one, CAS number: 5347-04-6, molecular formula: C14H15NO3, molecular weight: 245.27400), For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 4,4-diethyl-1-phenylpyrrolidine-2,3,5-trione |
|---|---|
| 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 | 1.408g/cm3 |
|---|---|
| Boiling Point | 443.9ºC at 760 mmHg |
| Molecular Formula | C14H15NO3 |
| Molecular Weight | 245.27400 |
| Flash Point | 222.3ºC |
| Exact Mass | 245.10500 |
| PSA | 54.45000 |
| LogP | 2.00030 |
| Index of Refraction | 1.693 |
| InChIKey | VSEHJVDPYBDZIH-UHFFFAOYSA-N |
| SMILES | CCC1(CC)C(=O)C(=O)N(c2ccccc2)C1=O |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2933990090 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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3-[(2-chlorophe... CAS#:5347-04-6 |
| Literature: Skinner; Ludwig Journal of the American Chemical Society, 1956 , vol. 78, p. 4656,4657 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 2 | |
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| DownStream 0 | |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2933990090 |
|---|---|
| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. 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.
| 4,4-diethyl-1-phenyl-pyrrolidine-2,3,5-trione |
| 3,3-Diethyl-1-phenyl-pyrrolidin-2,4,5-trion |
| 4,4-Diaethyl-1-phenyl-pyrrolidin-2,3,5-trion |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the CAS number of 4,4-diethyl-1-phenylpyrrolidine-2,3,5-trione? |
| A: CAS number of 4,4-diethyl-1-phenylpyrrolidine-2,3,5-trione is 5347-04-6. |
| Q: What are the upstream materials of 4,4-diethyl-1-phenylpyrrolidine-2,3,5-trione? |
| A: Related upstream materials(CAS) of 4,4-diethyl-1-phenylpyrrolidine-2,3,5-trione: 64-17-5;7325-42-0. |
| Q: What is the boiling point of 4,4-diethyl-1-phenylpyrrolidine-2,3,5-trione? |
| A: Boiling point of 4,4-diethyl-1-phenylpyrrolidine-2,3,5-trione is 443.9ºC at 760 mmHg. |
| Q: What is the molecular formula of 4,4-diethyl-1-phenylpyrrolidine-2,3,5-trione? |
| A: Molecular formula of 4,4-diethyl-1-phenylpyrrolidine-2,3,5-trione is C14H15NO3. |
| Q: What is the Chinese name of 5347-04-6? |
| A: Chinese name of 5347-04-6 is 5347-04-6. |
| Q: What English synonyms does 4,4-diethyl-1-phenylpyrrolidine-2,3,5-trione have? |
| A: English synonyms of 4,4-diethyl-1-phenylpyrrolidine-2,3,5-trione: 4,4-diethyl-1-phenyl-pyrrolidine-2,3,5-trione, 3,3-Diethyl-1-phenyl-pyrrolidin-2,4,5-trion, 4,4-Diaethyl-1-phenyl-pyrrolidin-2,3,5-trion. |
| Q: What is the SMILES notation of 4,4-diethyl-1-phenylpyrrolidine-2,3,5-trione? |
| A: SMILES notation of 4,4-diethyl-1-phenylpyrrolidine-2,3,5-trione is CCC1(CC)C(=O)C(=O)N(c2ccccc2)C1=O. |
| Q: What is the InChIKey of 4,4-diethyl-1-phenylpyrrolidine-2,3,5-trione? |
| A: InChIKey of 4,4-diethyl-1-phenylpyrrolidine-2,3,5-trione is VSEHJVDPYBDZIH-UHFFFAOYSA-N. |
| Q: What is the English name of 4,4-diethyl-1-phenylpyrrolidine-2,3,5-trione? |
| A: The English name of 4,4-diethyl-1-phenylpyrrolidine-2,3,5-trione is 4,4-diethyl-1-phenylpyrrolidine-2,3,5-trione. |
| Q: What is the polar surface area (PSA) of 4,4-diethyl-1-phenylpyrrolidine-2,3,5-trione? |
| A: Polar surface area (PSA) of 4,4-diethyl-1-phenylpyrrolidine-2,3,5-trione is 54.45000. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Dayang Chem (Hangzhou) Co., Ltd. |