3-hydroxy-4-methyl-5-nitrobenzoic acid
3-hydroxy-4-methyl-5-nitrobenzoic acid structure
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Common Name | 3-hydroxy-4-methyl-5-nitrobenzoic acid | ||
|---|---|---|---|---|
| CAS Number | 54591-64-9 | Molecular Weight | 197.14500 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C8H7NO5 | 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 | 3-hydroxy-4-methyl-5-nitrobenzoic 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 | C8H7NO5 |
|---|---|
| Molecular Weight | 197.14500 |
| Exact Mass | 197.03200 |
| PSA | 103.35000 |
| LogP | 1.83020 |
| InChIKey | JOXQJFFUMZMILL-UHFFFAOYSA-N |
| SMILES | Cc1c(O)cc(C(=O)O)cc1[N+](=O)[O-] |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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3-hydroxy-4-met... CAS#:54591-64-9 |
| Literature: Trost, Barry M.; O'Boyle, Brendan M.; Torres, Wildeliz; Ameriks, Michael K. Chemistry - A European Journal, 2011 , vol. 17, # 28 p. 7890 - 7903 |
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3-hydroxy-4-met... CAS#:54591-64-9 |
| Literature: Mochizuki, Akiyoshi; Nagata, Tsutomu; Kanno, Hideyuki; Takano, Daisuke; Kishida, Masamichi; Suzuki, Makoto; Ohta, Toshiharu Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 24 p. 7337 - 7343 |
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3-hydroxy-4-met... CAS#:54591-64-9 |
| Literature: Mochizuki, Akiyoshi; Nagata, Tsutomu; Kanno, Hideyuki; Takano, Daisuke; Kishida, Masamichi; Suzuki, Makoto; Ohta, Toshiharu Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 24 p. 7337 - 7343 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 3 | |
|---|---|
| DownStream 2 | |
CAS#:125229-14-3
CAS#:125229-13-2This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| Benzoic acid,3-hydroxy-4-methyl-5-nitro |
| 5-Nitro-3,4-cresotic acid |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the Chinese name of 54591-64-9? |
| A: Chinese name of 54591-64-9 is 54591-64-9. |
| Q: What is the InChIKey of 3-hydroxy-4-methyl-5-nitrobenzoic acid? |
| A: InChIKey of 3-hydroxy-4-methyl-5-nitrobenzoic acid is JOXQJFFUMZMILL-UHFFFAOYSA-N. |
| Q: What are the downstream products of 3-hydroxy-4-methyl-5-nitrobenzoic acid? |
| A: Related downstream products(CAS) of 3-hydroxy-4-methyl-5-nitrobenzoic acid: 125229-14-3;125229-13-2. |
| Q: What are the upstream materials of 3-hydroxy-4-methyl-5-nitrobenzoic acid? |
| A: Related upstream materials(CAS) of 3-hydroxy-4-methyl-5-nitrobenzoic acid: 16533-71-4;49592-71-4;72922-60-2. |
| Q: What is the LogP of 3-hydroxy-4-methyl-5-nitrobenzoic acid? |
| A: LogP of 3-hydroxy-4-methyl-5-nitrobenzoic acid is 1.83020. |
| Q: What is the molecular formula of 3-hydroxy-4-methyl-5-nitrobenzoic acid? |
| A: Molecular formula of 3-hydroxy-4-methyl-5-nitrobenzoic acid is C8H7NO5. |
| Q: What is the SMILES notation of 3-hydroxy-4-methyl-5-nitrobenzoic acid? |
| A: SMILES notation of 3-hydroxy-4-methyl-5-nitrobenzoic acid is Cc1c(O)cc(C(=O)O)cc1[N+](=O)[O-]. |
| Q: What is the molecular weight of 3-hydroxy-4-methyl-5-nitrobenzoic acid? |
| A: Molecular weight of 3-hydroxy-4-methyl-5-nitrobenzoic acid is 197.14500. |
| Q: What is the English name of 3-hydroxy-4-methyl-5-nitrobenzoic acid? |
| A: The English name of 3-hydroxy-4-methyl-5-nitrobenzoic acid is 3-hydroxy-4-methyl-5-nitrobenzoic acid. |
| Q: What is the CAS number of 3-hydroxy-4-methyl-5-nitrobenzoic acid? |
| A: CAS number of 3-hydroxy-4-methyl-5-nitrobenzoic acid is 54591-64-9. |