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| IUPAC Name: | tert-butyl N-[2-(4-bromophenyl)ethyl]carbamate |
| Description: | N-Boc-2-(4-bromophenyl)ethylamine (CAS# 120157-97-3) is a reagent used in the preparation of second-generation dual inhibitors of Cysteine protease falcipain-2 (FP-2) and Plasmodium falciparum dihydrofolate reductase (PfDHFR) which are crucial to malarial parasites. Also used in the preparation of indole-2-carboxamides as novel allosteric modulators of the cannabinoid (CB-1) receptor. |
| Molecular Weight: | 300.19 |
| Molecular Formula: | C13H18BrNO2 |
| Canonical SMILES: | CC(C)(C)OC(=O)NCCC1=CC=C(C=C1)Br |
| InChI: | InChI=1S/C13H18BrNO2/c1-13(2,3)17-12(16)15-9-8-10-4-6-11(14)7-5-10/h4-7H,8-9H2,1-3H3,(H,15,16) |
| InChI Key: | MRQBIMZMDWOQLF-UHFFFAOYSA-N |
| Boiling Point: | 389.6 ℃ at 760 mmHg |
| Density: | 1.286 g/cm3 |
| Storage: | Store at -20 ℃ |
| LogP: | 3.90720 |
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