4-(chloromethyl)phenyl methyl sulfide
4-(chloromethyl)phenyl methyl sulfide structure
|
Common Name | 4-(chloromethyl)phenyl methyl sulfide | ||
|---|---|---|---|---|
| CAS Number | 874-87-3 | Molecular Weight | 172.675 | |
| Density | 1.2±0.1 g/cm3 | Boiling Point | 262.3±23.0 °C at 760 mmHg | |
| Molecular Formula | C8H9ClS | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 110.5±19.8 °C | |
| Symbol |
GHS05 |
Signal Word | Danger | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 4-(Methylthio)benzyl chloride |
|---|---|
| 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 | 1.2±0.1 g/cm3 |
|---|---|
| Boiling Point | 262.3±23.0 °C at 760 mmHg |
| Molecular Formula | C8H9ClS |
| Molecular Weight | 172.675 |
| Flash Point | 110.5±19.8 °C |
| Exact Mass | 172.011353 |
| PSA | 25.30000 |
| LogP | 2.97 |
| Vapour Pressure | 0.0±0.5 mmHg at 25°C |
| Index of Refraction | 1.574 |
| InChIKey | VWVZFHRDLPHBEG-UHFFFAOYSA-N |
| SMILES | CSc1ccc(CCl)cc1 |
| Storage condition | 2-8°C |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Symbol |
GHS05 |
|---|---|
| Signal Word | Danger |
| Hazard Statements | H314 |
| Precautionary Statements | P280-P305 + P351 + P338-P310 |
| Personal Protective Equipment | Faceshields;full-face respirator (US);Gloves;Goggles;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Hazard Codes | C: Corrosive;Xi: Irritant; |
| Risk Phrases | R34;R36 |
| Safety Phrases | S26-S36/37/39-S45 |
| RIDADR | UN 1760 8/PG 2 |
| WGK Germany | 3 |
| Packaging Group | II |
| Hazard Class | 8.0 |
| HS Code | 2930909090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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4-(chloromethyl... CAS#:874-87-3 |
| Literature: Ranatunge, Ramani R.; Garvey, David S.; Janero, David R.; Letts, L. Gordon; Martino, Allison M.; Murty, Madhavi G.; Richardson, Stewart K.; Young, Delano V.; Zemetseva, Irina S. Bioorganic and Medicinal Chemistry, 2004 , vol. 12, # 6 p. 1357 - 1366 |
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4-(chloromethyl... CAS#:874-87-3 |
| Literature: US4599362 A1, ; |
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4-(chloromethyl... CAS#:874-87-3 |
| Literature: Journal of Medicinal Chemistry, , vol. 46, # 5 p. 856 - 867 |
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4-(chloromethyl... CAS#:874-87-3 |
| Literature: Journal of Organic Chemistry, , vol. 40, # 13 p. 1920 - 1923 |
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4-(chloromethyl... CAS#:874-87-3 |
| Literature: Journal of Organic Chemistry, , vol. 17, p. 350,356 |
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4-(chloromethyl... CAS#:874-87-3 |
| Literature: US2624738 , ; |
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4-(chloromethyl... CAS#:874-87-3 |
| Literature: Journal of the Chemical Society, , p. 1947 - 1954 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 8 | |
|---|---|
| DownStream 10 | |
CAS#:40517-43-9![[4-(Methylsulfanyl)phenyl]acetonitrile structure](https://image.chemsrc.com/caspic/473/38746-92-8.png)
CAS#:38746-92-8
CAS#:3446-89-7
CAS#:100-44-7
CAS#:109418-67-9![2,2-dichloro-N-(2-hydroxyethyl)-N-[(4-methylsulfanylphenyl)methyl]acetamide structure](https://image.chemsrc.com/caspic/240/3576-65-6.png)
CAS#:3576-65-6![N,N-dimethyl-4-[2-(4-methylsulfonylphenyl)ethenyl]aniline structure](https://image.chemsrc.com/caspic/004/120654-20-8.png)
CAS#:120654-20-8
CAS#:481679-70-3
CAS#:58472-47-2
CAS#:53605-96-2This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2930909090 |
|---|---|
| Summary | 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| EINECS 212-870-0 |
| 4-(chloromethyl)phenyl methyl sulfide |
| MFCD00270118 |
| 1-(chloromethyl)-4-methylsulfanylbenzene |
| 1-(Chloromethyl)-4-(methylsulfanyl)benzene |
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-(Methylthio)benzyl chloride? |
| A: Polar surface area (PSA) of 4-(Methylthio)benzyl chloride is 25.30000. |
| Q: What are the storage conditions for 4-(Methylthio)benzyl chloride? |
| A: Storage conditions for 4-(Methylthio)benzyl chloride: 2-8°C. |
| Q: What is the LogP of 4-(Methylthio)benzyl chloride? |
| A: LogP of 4-(Methylthio)benzyl chloride is 2.97. |
| Q: What is the boiling point of 4-(Methylthio)benzyl chloride? |
| A: Boiling point of 4-(Methylthio)benzyl chloride is 262.3±23.0 °C at 760 mmHg. |
| Q: What are the upstream materials of 4-(Methylthio)benzyl chloride? |
| A: Related upstream materials(CAS) of 4-(Methylthio)benzyl chloride: 3446-90-0;109-87-5;100-68-5;107-06-2;75-09-2;107-30-2;13205-48-6;3795-79-7. |
| Q: What is the InChIKey of 4-(Methylthio)benzyl chloride? |
| A: InChIKey of 4-(Methylthio)benzyl chloride is VWVZFHRDLPHBEG-UHFFFAOYSA-N. |
| Q: What English synonyms does 4-(Methylthio)benzyl chloride have? |
| A: English synonyms of 4-(Methylthio)benzyl chloride: EINECS 212-870-0, 4-(chloromethyl)phenyl methyl sulfide, MFCD00270118, 1-(chloromethyl)-4-methylsulfanylbenzene, 1-(Chloromethyl)-4-(methylsulfanyl)benzene. |
| Q: What is the English name of 4-(Methylthio)benzyl chloride? |
| A: The English name of 4-(Methylthio)benzyl chloride is 4-(Methylthio)benzyl chloride. |
| Q: What are the downstream products of 4-(Methylthio)benzyl chloride? |
| A: Related downstream products(CAS) of 4-(Methylthio)benzyl chloride: 40517-43-9;38746-92-8;3446-89-7;100-44-7;109418-67-9;3576-65-6;120654-20-8;481679-70-3;58472-47-2;53605-96-2. |
| Q: What is the safety information for 4-(Methylthio)benzyl chloride? |
| A: Safety information for 4-(Methylthio)benzyl chloride: S26-S36/37/39-S45. |
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. |