1-[(4-methylphenyl)sulfonylmethyl]pyridine; trifluoromethanesulfonic acid
![1-[(4-methylphenyl)sulfonylmethyl]pyridine; trifluoromethanesulfonic acid Structure](https://image.chemsrc.com/caspic/321/58747-50-5.png)
1-[(4-methylphenyl)sulfonylmethyl]pyridine; trifluoromethanesulfonic acid structure
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Common Name | 1-[(4-methylphenyl)sulfonylmethyl]pyridine; trifluoromethanesulfonic acid | ||
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| CAS Number | 58747-50-5 | Molecular Weight | 397.39000 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C14H14F3NO5S2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
Summary: 1-[(4-Methylphenyl)sulfonylmethyl]pyridin-1-ium, trifluoromethanesulfonate is an organic compound with CAS number 58747-50-5. Its molecular formula is C14H14F3NO5S2 and molecular weight is 397.39000. 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 | 1-[(4-methylphenyl)sulfonylmethyl]pyridin-1-ium,trifluoromethanesulfonate |
|---|---|
| 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.
| Molecular Formula | C14H14F3NO5S2 |
|---|---|
| Molecular Weight | 397.39000 |
| Exact Mass | 397.02700 |
| PSA | 111.98000 |
| LogP | 3.92690 |
| InChIKey | TVTJRKLPWKDQSQ-UHFFFAOYSA-M |
| SMILES | Cc1ccc(S(=O)(=O)C[n+]2ccccc2)cc1.O=S(=O)([O-])C(F)(F)F |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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1-[(4-methylphe... CAS#:58747-50-5 |
| Literature: Zhdankin; Erickson; Hanson Journal of the American Chemical Society, 1997 , vol. 119, # 20 p. 4775 - 4776 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 1 | |
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| DownStream 0 | |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 1-p-toluenesulfonylmethylpyridinium triflate |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What are the upstream materials of 1-[(4-methylphenyl)sulfonylmethyl]pyridin-1-ium,trifluoromethanesulfonate? |
| A: Related upstream materials(CAS) of 1-[(4-methylphenyl)sulfonylmethyl]pyridin-1-ium,trifluoromethanesulfonate: 37891-96-6. |
| Q: What is the polar surface area (PSA) of 1-[(4-methylphenyl)sulfonylmethyl]pyridin-1-ium,trifluoromethanesulfonate? |
| A: Polar surface area (PSA) of 1-[(4-methylphenyl)sulfonylmethyl]pyridin-1-ium,trifluoromethanesulfonate is 111.98000. |
| Q: What is the SMILES notation of 1-[(4-methylphenyl)sulfonylmethyl]pyridin-1-ium,trifluoromethanesulfonate? |
| A: SMILES notation of 1-[(4-methylphenyl)sulfonylmethyl]pyridin-1-ium,trifluoromethanesulfonate is Cc1ccc(S(=O)(=O)C[n+]2ccccc2)cc1.O=S(=O)([O-])C(F)(F)F. |
| Q: What is the molecular formula of 1-[(4-methylphenyl)sulfonylmethyl]pyridin-1-ium,trifluoromethanesulfonate? |
| A: Molecular formula of 1-[(4-methylphenyl)sulfonylmethyl]pyridin-1-ium,trifluoromethanesulfonate is C14H14F3NO5S2. |
| Q: What is the LogP of 1-[(4-methylphenyl)sulfonylmethyl]pyridin-1-ium,trifluoromethanesulfonate? |
| A: LogP of 1-[(4-methylphenyl)sulfonylmethyl]pyridin-1-ium,trifluoromethanesulfonate is 3.92690. |
| Q: What is the English name of 1-[(4-methylphenyl)sulfonylmethyl]pyridin-1-ium,trifluoromethanesulfonate? |
| A: The English name of 1-[(4-methylphenyl)sulfonylmethyl]pyridin-1-ium,trifluoromethanesulfonate is 1-[(4-methylphenyl)sulfonylmethyl]pyridin-1-ium,trifluoromethanesulfonate. |
| Q: What English synonyms does 1-[(4-methylphenyl)sulfonylmethyl]pyridin-1-ium,trifluoromethanesulfonate have? |
| A: English synonyms of 1-[(4-methylphenyl)sulfonylmethyl]pyridin-1-ium,trifluoromethanesulfonate: 1-p-toluenesulfonylmethylpyridinium triflate. |
| Q: What is the molecular weight of 1-[(4-methylphenyl)sulfonylmethyl]pyridin-1-ium,trifluoromethanesulfonate? |
| A: Molecular weight of 1-[(4-methylphenyl)sulfonylmethyl]pyridin-1-ium,trifluoromethanesulfonate is 397.39000. |
| Q: What is the InChIKey of 1-[(4-methylphenyl)sulfonylmethyl]pyridin-1-ium,trifluoromethanesulfonate? |
| A: InChIKey of 1-[(4-methylphenyl)sulfonylmethyl]pyridin-1-ium,trifluoromethanesulfonate is TVTJRKLPWKDQSQ-UHFFFAOYSA-M. |
| Q: What is the Chinese name of 58747-50-5? |
| A: Chinese name of 58747-50-5 is 58747-50-5. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Dayang Chem (Hangzhou) Co., Ltd. |