4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]sulfanylaniline
![4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]sulfanylaniline Structure](https://image.chemsrc.com/caspic/277/68596-41-8.png)
4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]sulfanylaniline structure
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Common Name | 4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]sulfanylaniline | ||
|---|---|---|---|---|
| CAS Number | 68596-41-8 | Molecular Weight | 343.21200 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C10H6F9NS | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]sulfanylaniline |
|---|---|
| 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 | C10H6F9NS |
|---|---|
| Molecular Weight | 343.21200 |
| Exact Mass | 343.00800 |
| PSA | 51.32000 |
| LogP | 5.36780 |
| InChIKey | BDVVMDWSFYEKCR-UHFFFAOYSA-N |
| SMILES | Nc1ccc(SC(C(F)(F)F)(C(F)(F)F)C(F)(F)F)cc1 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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4-[1,1,1,3,3,3-... CAS#:68596-41-8 |
| Literature: Kondratenko,N.V. et al. Journal of Organic Chemistry USSR (English Translation), 1978 , vol. 14, p. 1775 - 1778 Zhurnal Organicheskoi Khimii, 1978 , vol. 14, # 9 p. 1914 - 1917 |
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4-[1,1,1,3,3,3-... CAS#:68596-41-8 |
| Literature: Kondratenko,N.V. et al. Journal of Organic Chemistry USSR (English Translation), 1978 , vol. 14, p. 1775 - 1778 Zhurnal Organicheskoi Khimii, 1978 , vol. 14, # 9 p. 1914 - 1917 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 2 | |
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| DownStream 0 | |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Discovery of Small Molecules to Inhibit Human Cytomegalovirus Nuclear Egress
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: HCMV UL50
External Id: HMS1262
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Name: A screen for compounds that inhibit the activity of LtaS in Staphylococcus aureus
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id: HMS979
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Name: A screen for compounds that inhibit viral RNA polymerase binding and polymerization a...
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: Chain A, Poliovirus Polymerase With Gtp
External Id: HMS750
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| HMS1787G17 |
| p-Aminophenylperfluor-tert-butylsulfid |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the LogP of 4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]sulfanylaniline? |
| A: LogP of 4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]sulfanylaniline is 5.36780. |
| Q: What is the InChIKey of 4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]sulfanylaniline? |
| A: InChIKey of 4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]sulfanylaniline is BDVVMDWSFYEKCR-UHFFFAOYSA-N. |
| Q: What are the upstream materials of 4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]sulfanylaniline? |
| A: Related upstream materials(CAS) of 4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]sulfanylaniline: 68596-35-0;937-32-6. |
| Q: What is the molecular weight of 4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]sulfanylaniline? |
| A: Molecular weight of 4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]sulfanylaniline is 343.21200. |
| Q: What is the molecular formula of 4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]sulfanylaniline? |
| A: Molecular formula of 4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]sulfanylaniline is C10H6F9NS. |
| Q: What English synonyms does 4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]sulfanylaniline have? |
| A: English synonyms of 4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]sulfanylaniline: HMS1787G17, p-Aminophenylperfluor-tert-butylsulfid. |
| Q: What is the English name of 4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]sulfanylaniline? |
| A: The English name of 4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]sulfanylaniline is 4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]sulfanylaniline. |
| Q: What is the SMILES notation of 4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]sulfanylaniline? |
| A: SMILES notation of 4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]sulfanylaniline is Nc1ccc(SC(C(F)(F)F)(C(F)(F)F)C(F)(F)F)cc1. |
| Q: What is the CAS number of 4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]sulfanylaniline? |
| A: CAS number of 4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]sulfanylaniline is 68596-41-8. |
| Q: What is the polar surface area (PSA) of 4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]sulfanylaniline? |
| A: Polar surface area (PSA) of 4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]sulfanylaniline is 51.32000. |