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| IUPAC Name: | methyl 2-oxocyclohexane-1-carboxylate |
| Description: | Methyl 2-oxocyclohexanecarboxylate (CAS# 41302-34-5) is a novel intermediate for the preparation of TRPA1 antagonists for treatment of pain and other TRPA1-associated diseases. |
| Molecular Weight: | 156.18 |
| Molecular Formula: | C8H12O3 |
| Canonical SMILES: | COC(=O)C1CCCCC1=O |
| InChI: | InChI=1S/C8H12O3/c1-11-8(10)6-4-2-3-5-7(6)9/h6H,2-5H2,1H3 |
| InChI Key: | JEENWEAPRWGXSG-UHFFFAOYSA-N |
| Boiling Point: | 230.8 °C at 760 mmHg |
| Density: | 1.111 g/cm3 |
| Appearance: | Colorless clear liquid |
| MDL: | MFCD00077699 |
| LogP: | 0.91870 |
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