o-Tolyl p-toluenesulfonate
o-Tolyl p-toluenesulfonate structure
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Common Name | o-Tolyl p-toluenesulfonate | ||
|---|---|---|---|---|
| CAS Number | 599-75-7 | Molecular Weight | 262.32400 | |
| Density | 1.216g/cm3 | Boiling Point | 400.8ºC at 760 mmHg | |
| Molecular Formula | C14H14O3S | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 196.2ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | (2-methylphenyl) 4-methylbenzenesulfonate |
|---|---|
| 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 | 1.216g/cm3 |
|---|---|
| Boiling Point | 400.8ºC at 760 mmHg |
| Molecular Formula | C14H14O3S |
| Molecular Weight | 262.32400 |
| Flash Point | 196.2ºC |
| Exact Mass | 262.06600 |
| PSA | 51.75000 |
| LogP | 4.15190 |
| Index of Refraction | 1.575 |
| InChIKey | WBKWVLAHWVFXKM-UHFFFAOYSA-N |
| SMILES | Cc1ccc(S(=O)(=O)Oc2ccccc2C)cc1 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~98%
o-Tolyl p-tolue... CAS#:599-75-7 |
| Literature: Fazaeli, Razieh; Tangestaninejad, Shahram; Aliyan, Hamid Canadian Journal of Chemistry, 2006 , vol. 84, # 5 p. 812 - 818 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 2 | |
|---|---|
| DownStream 10 | |
CAS#:643-58-3
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CAS#:6840-26-2This 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.
| o-Tolyl p-toluenesulfonate |
| 2-MeC6H4OTs |
| o-tolyl 4-methylbenzenesulfonate |
| 2-tolyl tosylate |
| 2-methylphenyl p-toluenesulfonate |
| 2-methylphenyl 4-methylbenzenesulfonate |
| 2-methylphenyltosylate |
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 (2-methylphenyl) 4-methylbenzenesulfonate? |
| A: CAS number of (2-methylphenyl) 4-methylbenzenesulfonate is 599-75-7. |
| Q: What is the InChIKey of (2-methylphenyl) 4-methylbenzenesulfonate? |
| A: InChIKey of (2-methylphenyl) 4-methylbenzenesulfonate is WBKWVLAHWVFXKM-UHFFFAOYSA-N. |
| Q: What is the English name of (2-methylphenyl) 4-methylbenzenesulfonate? |
| A: The English name of (2-methylphenyl) 4-methylbenzenesulfonate is (2-methylphenyl) 4-methylbenzenesulfonate. |
| Q: What is the molecular formula of (2-methylphenyl) 4-methylbenzenesulfonate? |
| A: Molecular formula of (2-methylphenyl) 4-methylbenzenesulfonate is C14H14O3S. |
| Q: What is the LogP of (2-methylphenyl) 4-methylbenzenesulfonate? |
| A: LogP of (2-methylphenyl) 4-methylbenzenesulfonate is 4.15190. |
| Q: What is the molecular weight of (2-methylphenyl) 4-methylbenzenesulfonate? |
| A: Molecular weight of (2-methylphenyl) 4-methylbenzenesulfonate is 262.32400. |
| Q: What is the polar surface area (PSA) of (2-methylphenyl) 4-methylbenzenesulfonate? |
| A: Polar surface area (PSA) of (2-methylphenyl) 4-methylbenzenesulfonate is 51.75000. |
| Q: What are the upstream materials of (2-methylphenyl) 4-methylbenzenesulfonate? |
| A: Related upstream materials(CAS) of (2-methylphenyl) 4-methylbenzenesulfonate: 95-48-7;98-59-9. |
| Q: What English synonyms does (2-methylphenyl) 4-methylbenzenesulfonate have? |
| A: English synonyms of (2-methylphenyl) 4-methylbenzenesulfonate: o-Tolyl p-toluenesulfonate, 2-MeC6H4OTs, o-tolyl 4-methylbenzenesulfonate, 2-tolyl tosylate, 2-methylphenyl p-toluenesulfonate, 2-methylphenyl 4-methylbenzenesulfonate, 2-methylphenyltosylate. |
| Q: What is the SMILES notation of (2-methylphenyl) 4-methylbenzenesulfonate? |
| A: SMILES notation of (2-methylphenyl) 4-methylbenzenesulfonate is Cc1ccc(S(=O)(=O)Oc2ccccc2C)cc1. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Dayang Chem (Hangzhou) Co., Ltd. |