4-Tert-butyldiphenyl sulfide
4-Tert-butyldiphenyl sulfide structure
|
Common Name | 4-Tert-butyldiphenyl sulfide | ||
|---|---|---|---|---|
| CAS Number | 85609-03-6 | Molecular Weight | 242.379 | |
| Density | 1.1±0.1 g/cm3 | Boiling Point | 352.6±21.0 °C at 760 mmHg | |
| Molecular Formula | C16H18S | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 158.9±18.7 °C | |
Summary: 4-tert-Butyldiphenyl Sulfide (Chinese name: 4-叔丁基二苯硫醚，CAS number: 85609-03-6), molecular formula C16H18S, molecular weight 242.379, is a light yellow to green liquid. The boiling point is 352.6±21.0 °C, and the density is 1.1±0.1 g/cm3. 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-tert-Butyldiphenyl Sulfide |
|---|---|
| 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 | 1.1±0.1 g/cm3 |
|---|---|
| Boiling Point | 352.6±21.0 °C at 760 mmHg |
| Molecular Formula | C16H18S |
| Molecular Weight | 242.379 |
| Flash Point | 158.9±18.7 °C |
| Exact Mass | 242.112915 |
| PSA | 25.30000 |
| LogP | 6.14 |
| Vapour Pressure | 0.0±0.7 mmHg at 25°C |
| Index of Refraction | 1.594 |
| InChIKey | KGRAEJDVHXHGSQ-UHFFFAOYSA-N |
| SMILES | CC(C)(C)c1ccc(Sc2ccccc2)cc1 |
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.
| Hazard Codes | Xi |
|---|---|
| Risk Phrases | R41:Risk of serious damage to eyes. R36/37/38:Irritating to eyes, respiratory system and skin . |
| Safety Phrases | S26-S39 |
| WGK Germany | 3 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 10 | |
|---|---|
| DownStream 0 | |
CAS#:35779-04-5
CAS#:108-98-5
CAS#:123324-71-0
CAS#:931-59-9
CAS#:591-50-4
CAS#:2396-68-1
CAS#:108-86-1
CAS#:882-33-7
CAS#:3972-65-4
CAS#:3972-56-3This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 1-(2-Methyl-2-propanyl)-4-(phenylsulfanyl)benzene |
| MFCD06200845 |
| 4-Tert-butyldiphenyl sulfide |
| 4-tert-Butylphenyl phenyl sulfide |
| 1-tert-Butyl-4-(phenylsulfanyl)benzene |
| 1-tert-butyl-4-phenylsulfanylbenzene |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the English name of 4-tert-Butyldiphenyl Sulfide? |
| A: The English name of 4-tert-Butyldiphenyl Sulfide is 4-tert-Butyldiphenyl Sulfide. |
| Q: What is the molecular weight of 4-tert-Butyldiphenyl Sulfide? |
| A: Molecular weight of 4-tert-Butyldiphenyl Sulfide is 242.379. |
| Q: What English synonyms does 4-tert-Butyldiphenyl Sulfide have? |
| A: English synonyms of 4-tert-Butyldiphenyl Sulfide: 1-(2-Methyl-2-propanyl)-4-(phenylsulfanyl)benzene, MFCD06200845, 4-Tert-butyldiphenyl sulfide, 4-tert-Butylphenyl phenyl sulfide, 1-tert-Butyl-4-(phenylsulfanyl)benzene, 1-tert-butyl-4-phenylsulfanylbenzene. |
| Q: What is the LogP of 4-tert-Butyldiphenyl Sulfide? |
| A: LogP of 4-tert-Butyldiphenyl Sulfide is 6.14. |
| Q: What is the SMILES notation of 4-tert-Butyldiphenyl Sulfide? |
| A: SMILES notation of 4-tert-Butyldiphenyl Sulfide is CC(C)(C)c1ccc(Sc2ccccc2)cc1. |
| Q: What is the polar surface area (PSA) of 4-tert-Butyldiphenyl Sulfide? |
| A: Polar surface area (PSA) of 4-tert-Butyldiphenyl Sulfide is 25.30000. |
| Q: What is the CAS number of 4-tert-Butyldiphenyl Sulfide? |
| A: CAS number of 4-tert-Butyldiphenyl Sulfide is 85609-03-6. |
| Q: What is the InChIKey of 4-tert-Butyldiphenyl Sulfide? |
| A: InChIKey of 4-tert-Butyldiphenyl Sulfide is KGRAEJDVHXHGSQ-UHFFFAOYSA-N. |
| Q: What are the upstream materials of 4-tert-Butyldiphenyl Sulfide? |
| A: Related upstream materials(CAS) of 4-tert-Butyldiphenyl Sulfide: 35779-04-5;108-98-5;123324-71-0;931-59-9;591-50-4;2396-68-1;108-86-1;882-33-7;3972-65-4;3972-56-3. |
| Q: What is the molecular formula of 4-tert-Butyldiphenyl Sulfide? |
| A: Molecular formula of 4-tert-Butyldiphenyl Sulfide is C16H18S. |
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. |
| Zhongshan Xingrui Chemical Co. , Ltd. |
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- Shanghai Nianxing Industrial Co., Ltd
- China
- Product Name: 4-Tert-butyldiphenyl sulfide
- Price: Check
- Purity: 98.0%
- Delivery: 10 Day
- Contact: Yang
- Email: sales@echemcloud.com
- Dayang Chem (Hangzhou) Co., Ltd.
- China
- Product Name: 4-tert-Butyldiphenyl sulfide
- Price: $Inquiry/100g $Inquiry/1kg $Inquiry/100kg $Inquiry/1000kg
- Purity: 98.0%
- Delivery: Inquiry
- Contact: Ms Wang
- Email: enquiry@dycnchem.com
- Zhongshan Xingrui Chemical Co. , Ltd.
- China
- Product Name: 4-Tert-butyldiphenyl sulfide
- Price: ￥Inquiry/25kg
- Purity: 99.0%
- Delivery: Inquiry
- Contact: Wang Jie
- Email: 3096638339@qq.com
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