5-methoxy-2-methylsulfanylbenzoic acid
5-methoxy-2-methylsulfanylbenzoic acid structure
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Common Name | 5-methoxy-2-methylsulfanylbenzoic acid | ||
|---|---|---|---|---|
| CAS Number | 98752-37-5 | Molecular Weight | 198.23900 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C9H10O3S | 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 | 5-methoxy-2-methylsulfanylbenzoic 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 | C9H10O3S |
|---|---|
| Molecular Weight | 198.23900 |
| Exact Mass | 198.03500 |
| PSA | 71.83000 |
| LogP | 2.11530 |
| InChIKey | OQDTVSXRRUTQBW-UHFFFAOYSA-N |
| SMILES | COc1ccc(SC)c(C(=O)O)c1 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~62%
5-methoxy-2-met... CAS#:98752-37-5 |
| Literature: Nguyen, Thi-Huu; Chau, Nguyet Trang Thanh; Castanet, Anne-Sophie; Nguyen, Kim Phi Phung; Mortier, Jacques Organic Letters, 2005 , vol. 7, # 12 p. 2445 - 2448 |
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~%
5-methoxy-2-met... CAS#:98752-37-5 |
| Literature: Nguyen, Thi-Huu; Chau, Nguyet Trang Thanh; Castanet, Anne-Sophie; Nguyen, Kim Phi Phung; Mortier, Jacques Journal of Organic Chemistry, 2007 , vol. 72, # 9 p. 3419 - 3429 |
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~%
5-methoxy-2-met... CAS#:98752-37-5 |
| Literature: Nguyen, Thi-Huu; Chau, Nguyet Trang Thanh; Castanet, Anne-Sophie; Nguyen, Kim Phi Phung; Mortier, Jacques Journal of Organic Chemistry, 2007 , vol. 72, # 9 p. 3419 - 3429 |
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~%
5-methoxy-2-met... CAS#:98752-37-5
Learn More
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| Literature: Cipollina, Joseph A.; Ruediger, Edward H.; New, James S.; Wire, Mary E.; Shepherd, Timothy A.; et al. Journal of Medicinal Chemistry, 1991 , vol. 34, # 11 p. 3316 - 3328 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 5 | |
|---|---|
| DownStream 0 | |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 2-Methylthio-5-methoxybenzoesaeure |
| 3-methoxy-6-(methylthio)benzoic acid |
| Benzoic acid,5-methoxy-2-(methylthio) |
| 5-methoxy-2-(methylthio)benzoic acid |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the LogP of 5-methoxy-2-methylsulfanylbenzoic acid? |
| A: LogP of 5-methoxy-2-methylsulfanylbenzoic acid is 2.11530. |
| Q: What is the molecular formula of 5-methoxy-2-methylsulfanylbenzoic acid? |
| A: Molecular formula of 5-methoxy-2-methylsulfanylbenzoic acid is C9H10O3S. |
| Q: What is the molecular weight of 5-methoxy-2-methylsulfanylbenzoic acid? |
| A: Molecular weight of 5-methoxy-2-methylsulfanylbenzoic acid is 198.23900. |
| Q: What English synonyms does 5-methoxy-2-methylsulfanylbenzoic acid have? |
| A: English synonyms of 5-methoxy-2-methylsulfanylbenzoic acid: 2-Methylthio-5-methoxybenzoesaeure, 3-methoxy-6-(methylthio)benzoic acid, Benzoic acid,5-methoxy-2-(methylthio), 5-methoxy-2-(methylthio)benzoic acid. |
| Q: What is the InChIKey of 5-methoxy-2-methylsulfanylbenzoic acid? |
| A: InChIKey of 5-methoxy-2-methylsulfanylbenzoic acid is OQDTVSXRRUTQBW-UHFFFAOYSA-N. |
| Q: What are the upstream materials of 5-methoxy-2-methylsulfanylbenzoic acid? |
| A: Related upstream materials(CAS) of 5-methoxy-2-methylsulfanylbenzoic acid: 852623-20-2;852623-12-2;586-38-9;624-92-0;22921-68-2. |
| Q: What is the English name of 5-methoxy-2-methylsulfanylbenzoic acid? |
| A: The English name of 5-methoxy-2-methylsulfanylbenzoic acid is 5-methoxy-2-methylsulfanylbenzoic acid. |
| Q: What is the CAS number of 5-methoxy-2-methylsulfanylbenzoic acid? |
| A: CAS number of 5-methoxy-2-methylsulfanylbenzoic acid is 98752-37-5. |
| Q: What is the SMILES notation of 5-methoxy-2-methylsulfanylbenzoic acid? |
| A: SMILES notation of 5-methoxy-2-methylsulfanylbenzoic acid is COc1ccc(SC)c(C(=O)O)c1. |
| Q: What is the Chinese name of 98752-37-5? |
| A: Chinese name of 98752-37-5 is 98752-37-5. |