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| IUPAC Name: | 1H-indole-3-carboxylic acid |
| Description: | 1H-Indole-3-carboxylic acid can be found in the roots of Carpesium abrotanoides. |
| Molecular Weight: | 161.16 |
| Molecular Formula: | C9H7NO2 |
| Canonical SMILES: | C1=CC=C2C(=C1)C(=CN2)C(=O)O |
| InChI: | InChI=1S/C9H7NO2/c11-9(12)7-5-10-8-4-2-1-3-6(7)8/h1-5,10H,(H,11,12) |
| InChI Key: | KMAKOBLIOCQGJP-UHFFFAOYSA-N |
| Boiling Point: | 419.6 °C at 760 mmHg |
| Melting Point: | 232-234°C (dec.)(lit.) |
| Purity: | > 98 % |
| Density: | 1.408 g/cm3 |
| Solubility: | Soluble in 95% Ethanol: 50 mg/mL, also soluble in methanol. |
| Appearance: | Powder |
| Storage: | 2-8°C |
| MDL: | MFCD00005624 |
| LogP: | 1.86610 |
| Quality Standard: | Enterprise Standard |
| Refractive Index: | 1.5050 (estimate) |
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