5-Bromo-4-chloro-2-(methylsulfonyl)pyrimidine
5-Bromo-4-chloro-2-(methylsulfonyl)pyrimidine structure
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Common Name | 5-Bromo-4-chloro-2-(methylsulfonyl)pyrimidine | ||
|---|---|---|---|---|
| CAS Number | 79091-24-0 | Molecular Weight | 271.51900 | |
| Density | 1.862g/cm3 | Boiling Point | 431.3ºC at 760 mmHg | |
| Molecular Formula | C5H4BrClN2O2S | Melting Point | 102-106℃ | |
| MSDS | N/A | Flash Point | 214.6ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 5-bromo-4-chloro-2-methylsulfonylpyrimidine |
|---|---|
| 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 | 1.862g/cm3 |
|---|---|
| Boiling Point | 431.3ºC at 760 mmHg |
| Melting Point | 102-106℃ |
| Molecular Formula | C5H4BrClN2O2S |
| Molecular Weight | 271.51900 |
| Flash Point | 214.6ºC |
| Exact Mass | 269.88700 |
| PSA | 68.30000 |
| LogP | 2.37680 |
| Index of Refraction | 1.577 |
| InChIKey | FATRNESSGITUQV-UHFFFAOYSA-N |
| SMILES | CS(=O)(=O)c1ncc(Br)c(Cl)n1 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~88%
5-Bromo-4-chlor... CAS#:79091-24-0 |
| Literature: Hurst, Derek, T.; Johnson, Matthew Heterocycles, 1985 , vol. 23, # 3 p. 611 - 616 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 1 | |
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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 | 2933599090 |
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| Summary | 2933599090. other compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: NCI human tumor cell line growth inhibition assay. Data for the MCF7 Non-Small Cell L...
Source: DTP/NCI
Target: N/A
External Id: MCF7_OneDose
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Name: NCI human tumor cell line growth inhibition assay. Data for the IGROV1 Non-Small Cell...
Source: DTP/NCI
Target: N/A
External Id: IGROV1_OneDose
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 5-bromo-4-chloro-2-methylsulphonylpyrimidine |
| 5-BROMO-4-CHLORO-2-(METHYLSULFONYL)PYRIMIDINE |
| 5-BROMO-4-CHLORO-2-METHANESULFONYL-PYRIMIDINE |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the LogP of 5-bromo-4-chloro-2-methylsulfonylpyrimidine? |
| A: LogP of 5-bromo-4-chloro-2-methylsulfonylpyrimidine is 2.37680. |
| Q: What is the InChIKey of 5-bromo-4-chloro-2-methylsulfonylpyrimidine? |
| A: InChIKey of 5-bromo-4-chloro-2-methylsulfonylpyrimidine is FATRNESSGITUQV-UHFFFAOYSA-N. |
| Q: What is the boiling point of 5-bromo-4-chloro-2-methylsulfonylpyrimidine? |
| A: Boiling point of 5-bromo-4-chloro-2-methylsulfonylpyrimidine is 431.3ºC at 760 mmHg. |
| Q: What is the melting point of 5-bromo-4-chloro-2-methylsulfonylpyrimidine? |
| A: Melting point of 5-bromo-4-chloro-2-methylsulfonylpyrimidine is 102-106℃. |
| Q: What English synonyms does 5-bromo-4-chloro-2-methylsulfonylpyrimidine have? |
| A: English synonyms of 5-bromo-4-chloro-2-methylsulfonylpyrimidine: 5-bromo-4-chloro-2-methylsulphonylpyrimidine, 5-BROMO-4-CHLORO-2-(METHYLSULFONYL)PYRIMIDINE, 5-BROMO-4-CHLORO-2-METHANESULFONYL-PYRIMIDINE. |
| Q: What is the polar surface area (PSA) of 5-bromo-4-chloro-2-methylsulfonylpyrimidine? |
| A: Polar surface area (PSA) of 5-bromo-4-chloro-2-methylsulfonylpyrimidine is 68.30000. |
| Q: What is the SMILES notation of 5-bromo-4-chloro-2-methylsulfonylpyrimidine? |
| A: SMILES notation of 5-bromo-4-chloro-2-methylsulfonylpyrimidine is CS(=O)(=O)c1ncc(Br)c(Cl)n1. |
| Q: What is the safety information for 5-bromo-4-chloro-2-methylsulfonylpyrimidine? |
| A: Safety information for 5-bromo-4-chloro-2-methylsulfonylpyrimidine: 36/37. |
| Q: What is the molecular weight of 5-bromo-4-chloro-2-methylsulfonylpyrimidine? |
| A: Molecular weight of 5-bromo-4-chloro-2-methylsulfonylpyrimidine is 271.51900. |
| Q: What is the English name of 5-bromo-4-chloro-2-methylsulfonylpyrimidine? |
| A: The English name of 5-bromo-4-chloro-2-methylsulfonylpyrimidine is 5-bromo-4-chloro-2-methylsulfonylpyrimidine. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |