4-methyl-3-phenylsulfanylpentan-2-one
4-methyl-3-phenylsulfanylpentan-2-one structure
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Common Name | 4-methyl-3-phenylsulfanylpentan-2-one | ||
|---|---|---|---|---|
| CAS Number | 27872-69-1 | Molecular Weight | 208.32000 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C12H16OS | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
Summary: 4-Methyl-3-phenylsulfanylpentan-2-one (CAS号：27872-69-1)，molecular formula C12H16OS，molecular weight 208.32000，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-methyl-3-phenylsulfanylpentan-2-one |
|---|---|
| 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 | C12H16OS |
|---|---|
| Molecular Weight | 208.32000 |
| Exact Mass | 208.09200 |
| PSA | 42.37000 |
| LogP | 3.39230 |
| InChIKey | ANRGSDIZJSOTHJ-UHFFFAOYSA-N |
| SMILES | CC(=O)C(Sc1ccccc1)C(C)C |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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4-methyl-3-phen... CAS#:27872-69-1 |
| Literature: Chan,T.H.; Ong,B.S. Journal of Organic Chemistry, 1978 , vol. 43, # 15 p. 2994 - 3001 |
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4-methyl-3-phen... CAS#:27872-69-1 |
| Literature: Pusino, Alba; Rosnati, Vittorio; Saba, Antonio; Franco, Andrea Gazzetta Chimica Italiana, 1982 , vol. 112, # 11/12 p. 475 - 482 |
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4-methyl-3-phen... CAS#:27872-69-1 |
| Literature: Samson,M. et al. Bulletin des Societes Chimiques Belges, 1977 , vol. 86, p. 329 - 330 |
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4-methyl-3-phen... CAS#:27872-69-1 |
| Literature: MacNicol,D.D.; McKendrick,J.J. Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1974 , p. 2493 - 2496 |
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4-methyl-3-phen... CAS#:27872-69-1 |
| Literature: Brownbridge,P.; Warren,S. Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1977 , p. 1131 - 1141 |
![[2-(chloromethyl)-3-propan-2-yloxiran-2-yl]-trimethylsilane structure](https://image.chemsrc.com/caspic/059/61628-47-5.png)
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 9 | |
|---|---|
| DownStream 0 | |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 4-methyl-3-phenylthio-2-pentanone |
| 4-methyl-3-phenylthiopentan-2-one |
| 2-Pentanone,4-methyl-3-(phenylthio) |
| 4-Methyl-3-(phenylthio)-pentan-2-on |
| (1-Phenylmercapto-isobutyl)-methyl-keton |
| 4-Methyl-3-phenylthiopentanon-2 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular formula of 4-methyl-3-phenylsulfanylpentan-2-one? |
| A: Molecular formula of 4-methyl-3-phenylsulfanylpentan-2-one is C12H16OS. |
| Q: What is the Chinese name of 27872-69-1? |
| A: Chinese name of 27872-69-1 is 27872-69-1. |
| Q: What is the CAS number of 4-methyl-3-phenylsulfanylpentan-2-one? |
| A: CAS number of 4-methyl-3-phenylsulfanylpentan-2-one is 27872-69-1. |
| Q: What is the English name of 4-methyl-3-phenylsulfanylpentan-2-one? |
| A: The English name of 4-methyl-3-phenylsulfanylpentan-2-one is 4-methyl-3-phenylsulfanylpentan-2-one. |
| Q: What is the LogP of 4-methyl-3-phenylsulfanylpentan-2-one? |
| A: LogP of 4-methyl-3-phenylsulfanylpentan-2-one is 3.39230. |
| Q: What is the InChIKey of 4-methyl-3-phenylsulfanylpentan-2-one? |
| A: InChIKey of 4-methyl-3-phenylsulfanylpentan-2-one is ANRGSDIZJSOTHJ-UHFFFAOYSA-N. |
| Q: What is the molecular weight of 4-methyl-3-phenylsulfanylpentan-2-one? |
| A: Molecular weight of 4-methyl-3-phenylsulfanylpentan-2-one is 208.32000. |
| Q: What are the upstream materials of 4-methyl-3-phenylsulfanylpentan-2-one? |
| A: Related upstream materials(CAS) of 4-methyl-3-phenylsulfanylpentan-2-one: 108-98-5;61628-47-5;917-54-4;141-79-7;882-33-7;930-69-8;29585-01-1;75-30-9;5042-53-5. |
| Q: What English synonyms does 4-methyl-3-phenylsulfanylpentan-2-one have? |
| A: English synonyms of 4-methyl-3-phenylsulfanylpentan-2-one: 4-methyl-3-phenylthio-2-pentanone, 4-methyl-3-phenylthiopentan-2-one, 2-Pentanone,4-methyl-3-(phenylthio), 4-Methyl-3-(phenylthio)-pentan-2-on, (1-Phenylmercapto-isobutyl)-methyl-keton, 4-Methyl-3-phenylthiopentanon-2. |
| Q: What is the SMILES notation of 4-methyl-3-phenylsulfanylpentan-2-one? |
| A: SMILES notation of 4-methyl-3-phenylsulfanylpentan-2-one is CC(=O)C(Sc1ccccc1)C(C)C. |