2-(acetylsulfanylmethyl)-2-methylbutanoic acid
2-(acetylsulfanylmethyl)-2-methylbutanoic acid structure
|
Common Name | 2-(acetylsulfanylmethyl)-2-methylbutanoic acid | ||
|---|---|---|---|---|
| CAS Number | 656241-05-3 | Molecular Weight | 190.26000 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C8H14O3S | 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 | 2-(acetylsulfanylmethyl)-2-methylbutanoic acid |
|---|---|
| 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 | C8H14O3S |
|---|---|
| Molecular Weight | 190.26000 |
| Exact Mass | 190.06600 |
| PSA | 79.67000 |
| LogP | 1.76700 |
| InChIKey | WQOGCQBCMFJGTO-UHFFFAOYSA-N |
| SMILES | CCC(C)(CSC(C)=O)C(=O)O |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~87%
2-(acetylsulfan... CAS#:656241-05-3 |
| Literature: Lee, Hyun Soo; Kim, Dong H. Bioorganic and Medicinal Chemistry, 2003 , vol. 11, # 22 p. 4685 - 4691 |
|
~%
2-(acetylsulfan... CAS#:656241-05-3 |
| Literature: Lee, Hyun Soo; Kim, Dong H. Bioorganic and Medicinal Chemistry, 2003 , vol. 11, # 22 p. 4685 - 4691 |
|
~%
2-(acetylsulfan... CAS#:656241-05-3 |
| Literature: Lee, Hyun Soo; Kim, Dong H. Bioorganic and Medicinal Chemistry, 2003 , vol. 11, # 22 p. 4685 - 4691 |
|
~%
2-(acetylsulfan... CAS#:656241-05-3 |
| Literature: Lee, Hyun Soo; Kim, Dong H. Bioorganic and Medicinal Chemistry, 2003 , vol. 11, # 22 p. 4685 - 4691 |
|
~%
2-(acetylsulfan... CAS#:656241-05-3 |
| Literature: Lee, Hyun Soo; Kim, Dong H. Bioorganic and Medicinal Chemistry, 2003 , vol. 11, # 22 p. 4685 - 4691 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 6 | |
|---|---|
| DownStream 0 | |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| Butanoic acid,2-[(acetylthio)methyl]-2-methyl |
| 2-acetylsulfanylmethyl-2-methylbutanoic acid |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the InChIKey of 2-(acetylsulfanylmethyl)-2-methylbutanoic acid? |
| A: InChIKey of 2-(acetylsulfanylmethyl)-2-methylbutanoic acid is WQOGCQBCMFJGTO-UHFFFAOYSA-N. |
| Q: What is the molecular formula of 2-(acetylsulfanylmethyl)-2-methylbutanoic acid? |
| A: Molecular formula of 2-(acetylsulfanylmethyl)-2-methylbutanoic acid is C8H14O3S. |
| Q: What is the CAS number of 2-(acetylsulfanylmethyl)-2-methylbutanoic acid? |
| A: CAS number of 2-(acetylsulfanylmethyl)-2-methylbutanoic acid is 656241-05-3. |
| Q: What are the upstream materials of 2-(acetylsulfanylmethyl)-2-methylbutanoic acid? |
| A: Related upstream materials(CAS) of 2-(acetylsulfanylmethyl)-2-methylbutanoic acid: 58230-48-1;10387-40-3;77-84-9;656241-03-1;656241-04-2;2049-70-9. |
| Q: What is the polar surface area (PSA) of 2-(acetylsulfanylmethyl)-2-methylbutanoic acid? |
| A: Polar surface area (PSA) of 2-(acetylsulfanylmethyl)-2-methylbutanoic acid is 79.67000. |
| Q: What English synonyms does 2-(acetylsulfanylmethyl)-2-methylbutanoic acid have? |
| A: English synonyms of 2-(acetylsulfanylmethyl)-2-methylbutanoic acid: Butanoic acid,2-[(acetylthio)methyl]-2-methyl, 2-acetylsulfanylmethyl-2-methylbutanoic acid. |
| Q: What is the English name of 2-(acetylsulfanylmethyl)-2-methylbutanoic acid? |
| A: The English name of 2-(acetylsulfanylmethyl)-2-methylbutanoic acid is 2-(acetylsulfanylmethyl)-2-methylbutanoic acid. |
| Q: What is the LogP of 2-(acetylsulfanylmethyl)-2-methylbutanoic acid? |
| A: LogP of 2-(acetylsulfanylmethyl)-2-methylbutanoic acid is 1.76700. |
| Q: What is the SMILES notation of 2-(acetylsulfanylmethyl)-2-methylbutanoic acid? |
| A: SMILES notation of 2-(acetylsulfanylmethyl)-2-methylbutanoic acid is CCC(C)(CSC(C)=O)C(=O)O. |
| Q: What is the Chinese name of 656241-05-3? |
| A: Chinese name of 656241-05-3 is 656241-05-3. |