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| IUPAC Name: | 4-bromobutanoic acid |
| Description: | 4-Bromobutyric acid (CAS# 2623-87-2) is used in the preparation of analgesic and anti-inflammatory agents as nitroalkyl ethers. It is also used in the synthesis of Autotaxin (ENPP2) inhibitors, used in tissue fibrosis regulation, cancer cell invasion and metastasis. |
| Molecular Weight: | 167.00 |
| Molecular Formula: | C4H7BrO2 |
| Canonical SMILES: | C(CC(=O)O)CBr |
| InChI: | InChI=1S/C4H7BrO2/c5-3-1-2-4(6)7/h1-3H2,(H,6,7) |
| InChI Key: | GRHQDJDRGZFIPO-UHFFFAOYSA-N |
| Boiling Point: | 128-131 °C (11 mmHg) |
| Purity: | 95 % |
| Density: | 1.631 g/cm3 |
| MDL: | MFCD00002817 |
| LogP: | 1.24610 |
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