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| IUPAC Name: | 5-bromo-2,3-dihydro-1H-indole |
| Description: | 5-Bromoindoline (CAS# 22190-33-6) is a brominated indoline derivative and a product of biocatalyzed halogenation of nucleobase analogs. 5-Bromoindoline is used in the synthetic preparation of biologically active compounds such as selective human β3 adrenergic receptor agonists. |
| Molecular Weight: | 198.06 |
| Molecular Formula: | C8H8BrN |
| Canonical SMILES: | C1CNC2=C1C=C(C=C2)Br |
| InChI: | InChI=1S/C8H8BrN/c9-7-1-2-8-6(5-7)3-4-10-8/h1-2,5,10H,3-4H2 |
| InChI Key: | QEDCHCLHHGGYBT-UHFFFAOYSA-N |
| Boiling Point: | 114-115 °C / 5 mmHg |
| Melting Point: | 36-40 °C |
| Purity: | 98 % |
| Density: | 1.514 g/cm3 |
| Appearance: | White to brown low melting solid |
| MDL: | MFCD00027410 |
| LogP: | 2.55510 |
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