1-(5-fluoropentyl)-1H-indole-3-carboxylic acid
- Product Name1-(5-fluoropentyl)-1H-indole-3-carboxylic acid
- CAS1432794-98-3
- MFC14H16FNO2
- MW249.28
- EINECS
- MOL File1432794-98-3.mol
Chemical Properties
| Boiling point | 439.9±25.0 °C(Predicted) |
| Density | 1.19±0.1 g/cm3(Predicted) |
| storage temp. | -20°C |
| solubility | DMF: 30mg/ml; DMSO: 30mg/ml; DMSO:PBS(pH7.2) (1:1): 0.5 mg/ml; Ethanol: 10 mg/ml |
| form | A neat solid |
| pka | 4.00±0.10(Predicted) |
| Major Application | forensics and toxicology forensics and toxicology |
| InChI | 1S/C14H16FNO2/c15-8-4-1-5-9-16-10-12(14(17)18)11-6-2-3-7-13(11)16/h2-3,6-7,10H,1,4-5,8-9H2,(H,17,18) |
| InChIKey | DYLIZXRQZRUDLA-UHFFFAOYSA-N |
| SMILES | O=C(O)C1=CN(CCCCCF)C2=CC=CC=C21 |
Safety Information
| RIDADR | UN 1648 3 / PGII |
| WGK Germany | WGK 2 |
| Storage Class | 3 - Flammable liquids |
| Hazard Classifications | Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Acute Tox. 4 Oral Eye Irrit. 2 Flam. Liq. 2 |
