3-methylindole-1-carboxylic acid
3-methylindole-1-carboxylic acid structure
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Common Name | 3-methylindole-1-carboxylic acid | ||
|---|---|---|---|---|
| CAS Number | 65610-64-2 | Molecular Weight | 175.18400 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C10H9NO2 | 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-methylindole-1-carboxylic 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 | C10H9NO2 |
|---|---|
| Molecular Weight | 175.18400 |
| Exact Mass | 175.06300 |
| PSA | 42.23000 |
| LogP | 2.47580 |
| InChIKey | YYSXDZTZYZCUOW-UHFFFAOYSA-N |
| SMILES | Cc1cn(C(=O)O)c2ccccc12 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~92%
3-methylindole-... CAS#:65610-64-2 |
| Literature: Grehn, Leif; Ragnarsson, Ulf Angewandte Chemie, 1984 , vol. 96, # 4 p. 291 - 292 |
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~%
3-methylindole-... CAS#:65610-64-2 |
| Literature: Wassenaar, Jeroen; Reek, Joost N. H. Dalton Transactions, 2007 , # 34 p. 3750 - 3753 |
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~%
3-methylindole-... CAS#:65610-64-2 |
| Literature: Oddo Gazzetta Chimica Italiana, 1912 , vol. 42 I, p. 365,370 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 3 | |
|---|---|
| DownStream 2 | |
CAS#:800369-69-1This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 1-carboxyl-3-methylindole |
| 3-Methyl-1-indolcarbonsaeure |
| 3-methyl-indole-1-carboxylic acid |
| 1H-Indole-1-carboxylic acid,3-methyl |
| 3-Methyl-indol-1-carbonsaeure |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the SMILES notation of 3-methylindole-1-carboxylic acid? |
| A: SMILES notation of 3-methylindole-1-carboxylic acid is Cc1cn(C(=O)O)c2ccccc12. |
| Q: What is the LogP of 3-methylindole-1-carboxylic acid? |
| A: LogP of 3-methylindole-1-carboxylic acid is 2.47580. |
| Q: What is the InChIKey of 3-methylindole-1-carboxylic acid? |
| A: InChIKey of 3-methylindole-1-carboxylic acid is YYSXDZTZYZCUOW-UHFFFAOYSA-N. |
| Q: What are the downstream products of 3-methylindole-1-carboxylic acid? |
| A: Related downstream products(CAS) of 3-methylindole-1-carboxylic acid: 83-34-1;800369-69-1. |
| Q: What is the polar surface area (PSA) of 3-methylindole-1-carboxylic acid? |
| A: Polar surface area (PSA) of 3-methylindole-1-carboxylic acid is 42.23000. |
| Q: What English synonyms does 3-methylindole-1-carboxylic acid have? |
| A: English synonyms of 3-methylindole-1-carboxylic acid: 1-carboxyl-3-methylindole, 3-Methyl-1-indolcarbonsaeure, 3-methyl-indole-1-carboxylic acid, 1H-Indole-1-carboxylic acid,3-methyl, 3-Methyl-indol-1-carbonsaeure. |
| Q: What is the English name of 3-methylindole-1-carboxylic acid? |
| A: The English name of 3-methylindole-1-carboxylic acid is 3-methylindole-1-carboxylic acid. |
| Q: What is the CAS number of 3-methylindole-1-carboxylic acid? |
| A: CAS number of 3-methylindole-1-carboxylic acid is 65610-64-2. |
| Q: What is the Chinese name of 65610-64-2? |
| A: Chinese name of 65610-64-2 is 65610-64-2. |
| Q: What is the molecular weight of 3-methylindole-1-carboxylic acid? |
| A: Molecular weight of 3-methylindole-1-carboxylic acid is 175.18400. |