Oxagrelate
[CAS# 56611-65-5]

Identification

• Name: Oxagrelate
• Synonyms: 1-(Hydroxymethyl)-5,7-Dimethyl-4-Oxo-3H-Phthalazine-6-Carboxylic Acid Ethyl Ester; 4-Keto-5,7-Dimethyl-1-Methylol-3H-Phthalazine-6-Carboxylic Acid Ethyl Ester; Ethyl 1-(Hydroxymethyl)-5,7-Dimethyl-4-Oxo-3,4-Dihydrophthalazine-6-Carboxylate
• Molecular Formula: C₁₄H₁₆N₂O₄
• Molecular Weight: 276.29
• CAS Registry Number: 56611-65-5
• SMILES: C1=C2C(=C(C(=C1C)C(OCC)=O)C)C(NN=C2CO)=O
• InChI: 1S/C14H16N2O4/c1-4-20-14(19)11-7(2)5-9-10(6-17)15-16-13(18)12(9)8(11)3/h5,17H,4,6H2,1-3H3,(H,16,18)
• InChIKey: DUQOOLBWGUKRAJ-UHFFFAOYSA-N

Properties

• Density: 1.34g/cm³ (Cal.)