1-chloro-4-(4-methylphenyl)sulfonyloxy-benzene
1-chloro-4-(4-methylphenyl)sulfonyloxy-benzene structure
|
Common Name | 1-chloro-4-(4-methylphenyl)sulfonyloxy-benzene | ||
|---|---|---|---|---|
| CAS Number | 599-89-3 | Molecular Weight | 282.74300 | |
| Density | 1.337g/cm3 | Boiling Point | 415.6ºC at 760 mmHg | |
| Molecular Formula | C13H11ClO3S | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 205.2ºC | |
Summary: (4-chlorophenyl) 4-methylbenzenesulfonate, Chinese name not provided, CAS number 599-89-3, molecular formula C13H11ClO3S, molecular weight 282.74300. 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-chlorophenyl) 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 | 1.337g/cm3 |
|---|---|
| Boiling Point | 415.6ºC at 760 mmHg |
| Molecular Formula | C13H11ClO3S |
| Molecular Weight | 282.74300 |
| Flash Point | 205.2ºC |
| Exact Mass | 282.01200 |
| PSA | 51.75000 |
| LogP | 4.49690 |
| Index of Refraction | 1.591 |
| InChIKey | PPRVVAPBLOBOSE-UHFFFAOYSA-N |
| SMILES | Cc1ccc(S(=O)(=O)Oc2ccc(Cl)cc2)cc1 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~93%
1-chloro-4-(4-m... CAS#:599-89-3 |
| Literature: Reddy, M. B. Madhusudana; Pasha Phosphorus, Sulfur and Silicon and the Related Elements, 2011 , vol. 186, # 9 p. 1867 - 1875 |
|
~82%
1-chloro-4-(4-m... CAS#:599-89-3 |
| Literature: Wang, Xi-Cun; Yang, Guo-Jun; Quan, Zheng-Jun; Ji, Peng-Yan; Liang, Jun-Ling; Ren, Rong-Guo Synlett, 2010 , # 11 p. 1657 - 1660 |
|
~54%
1-chloro-4-(4-m... CAS#:599-89-3 |
| Literature: Sakurai, Naoto; Mukaiyama, Teruaki Heterocycles, 2007 , vol. 74, # C p. 771 - 790 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 3 | |
|---|---|
| DownStream 10 | |
CAS#:108-95-2![N-[(4-chlorophenyl)methyl]-4-methylbenzenesulfonamide structure](https://image.chemsrc.com/caspic/453/10504-98-0.png)
CAS#:10504-98-0![4-chloro-N-[(4-chlorophenyl)methyl]aniline structure](https://image.chemsrc.com/caspic/259/13159-74-5.png)
CAS#:13159-74-5![N-[(4-Methoxyphenyl)Methyl]-4-Methylbenzenesulfonamide structure](https://image.chemsrc.com/caspic/095/54879-64-0.png)
CAS#:54879-64-0![4-chloro-N-[(4-methoxyphenyl)methyl]aniline structure](https://image.chemsrc.com/caspic/148/104329-18-2.png)
CAS#:104329-18-2
CAS#:2948-37-0
CAS#:1576-37-0![4-methyl-N-[(4-methylphenyl)methyl]benzenesulfonamide structure](https://image.chemsrc.com/caspic/191/10504-92-4.png)
CAS#:10504-92-4This table contains target information, in‑vitro & in‑vivo assay data for this compound.
|
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
|
|
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
|
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 4-chlorophenol tosylate |
| 4-chlorophenyl 4-methylbenzenesulfonate |
| toluene-4-sulfonic acid 4-chlorophenyl ester |
| 4-chlorophenyl tosylate |
| 4-chlorophenyl p-toluenesulfonate |
| p-Chlorophenyl-p-toluenesulfonate |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the polar surface area (PSA) of (4-chlorophenyl) 4-methylbenzenesulfonate? |
| A: Polar surface area (PSA) of (4-chlorophenyl) 4-methylbenzenesulfonate is 51.75000. |
| Q: What are the upstream materials of (4-chlorophenyl) 4-methylbenzenesulfonate? |
| A: Related upstream materials(CAS) of (4-chlorophenyl) 4-methylbenzenesulfonate: 106-48-9;98-59-9;104-15-4. |
| Q: What is the molecular weight of (4-chlorophenyl) 4-methylbenzenesulfonate? |
| A: Molecular weight of (4-chlorophenyl) 4-methylbenzenesulfonate is 282.74300. |
| Q: What is the Chinese name of 599-89-3? |
| A: Chinese name of 599-89-3 is 599-89-3. |
| Q: What are the downstream products of (4-chlorophenyl) 4-methylbenzenesulfonate? |
| A: Related downstream products(CAS) of (4-chlorophenyl) 4-methylbenzenesulfonate: 106-48-9;108-95-2;10504-98-0;13159-74-5;104-15-4;54879-64-0;104329-18-2;2948-37-0;1576-37-0;10504-92-4. |
| Q: What is the boiling point of (4-chlorophenyl) 4-methylbenzenesulfonate? |
| A: Boiling point of (4-chlorophenyl) 4-methylbenzenesulfonate is 415.6ºC at 760 mmHg. |
| Q: What English synonyms does (4-chlorophenyl) 4-methylbenzenesulfonate have? |
| A: English synonyms of (4-chlorophenyl) 4-methylbenzenesulfonate: 4-chlorophenol tosylate, 4-chlorophenyl 4-methylbenzenesulfonate, toluene-4-sulfonic acid 4-chlorophenyl ester, 4-chlorophenyl tosylate, 4-chlorophenyl p-toluenesulfonate, p-Chlorophenyl-p-toluenesulfonate. |
| Q: What is the English name of (4-chlorophenyl) 4-methylbenzenesulfonate? |
| A: The English name of (4-chlorophenyl) 4-methylbenzenesulfonate is (4-chlorophenyl) 4-methylbenzenesulfonate. |
| Q: What is the SMILES notation of (4-chlorophenyl) 4-methylbenzenesulfonate? |
| A: SMILES notation of (4-chlorophenyl) 4-methylbenzenesulfonate is Cc1ccc(S(=O)(=O)Oc2ccc(Cl)cc2)cc1. |
| Q: What is the InChIKey of (4-chlorophenyl) 4-methylbenzenesulfonate? |
| A: InChIKey of (4-chlorophenyl) 4-methylbenzenesulfonate is PPRVVAPBLOBOSE-UHFFFAOYSA-N. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Dayang Chem (Hangzhou) Co., Ltd. |