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| IUPAC Name: | 3-oxo-3-phenylmethoxypropanoic acid |
| Description: | mono-Benzyl malonate (CAS# 40204-26-0) is a useful synthetic intermediate. It was used to synthesize constrained cyclic agonists of the cholecystokinin CCK-B receptor. It was also used to prepare aspartate transcarbamoylase inhibitors. |
| Molecular Weight: | 194.18 |
| Molecular Formula: | C10H10O4 |
| Canonical SMILES: | C1=CC=C(C=C1)COC(=O)CC(=O)O |
| InChI: | InChI=1S/C10H10O4/c11-9(12)6-10(13)14-7-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,12) |
| InChI Key: | CFLAHQSWDKNWPW-UHFFFAOYSA-N |
| Boiling Point: | 352.3 °C at 760 mmHg |
| Density: | 1.266 g/cm3 |
| Appearance: | Solid |
| MDL: | MFCD00138132 |
| LogP: | 1.20450 |
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Carbonyl Compounds
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
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