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| IUPAC Name: | 4-oxoadamantane-1-carboxylic acid |
| Description: | 4-Oxo-1-adamantanecarboxylic Acid (CAS# 56674-87-4) is a reactant used in the synthesis of potent inhibitors targeting the drug-resistant mutant of Influenze A. Starting material for Saxagliptin impurities. |
| Molecular Weight: | 194.23 |
| Molecular Formula: | C11H14O3 |
| Canonical SMILES: | C1C2CC3CC(C2)(CC1C3=O)C(=O)O |
| InChI: | InChI=1S/C11H14O3/c12-9-7-1-6-2-8(9)5-11(3-6,4-7)10(13)14/h6-8H,1-5H2,(H,13,14) |
| InChI Key: | VFNJWHFPIRNNRQ-UHFFFAOYSA-N |
| Boiling Point: | 367.6 ℃ at 760 mmHg |
| Density: | 1.358 g/cm3 |
| MDL: | MFCD01825769 |
| LogP: | 1.46640 |
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