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| IUPAC Name: | 3-formylbenzonitrile |
| Description: | 3-Formylbenzonitrile (CAS# 24964-64-5) is a versatile reactant used in the preparation of 4-benzyl-2H-phthalazin-1-ones that are inhibitors of the Poly(ADP-ribose) polymerases PARP-1 and PARP-2. |
| Molecular Weight: | 131.13 |
| Molecular Formula: | C8H5NO |
| Canonical SMILES: | C1=CC(=CC(=C1)C=O)C#N |
| InChI: | InChI=1S/C8H5NO/c9-5-7-2-1-3-8(4-7)6-10/h1-4,6H |
| InChI Key: | HGZJJKZPPMFIBU-UHFFFAOYSA-N |
| Boiling Point: | 210 °C |
| Purity: | 98 % |
| Density: | 1.15 g/cm3 |
| Appearance: | White to light yellow cryst. powder or chunks |
| MDL: | MFCD00003344 |
| LogP: | 1.37078 |
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Carbonyl Compounds
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
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