4-[5-(4-Methoxy-phenyl)-3-thiophen-2-yl-4,5-dihydro-pyrazol-1-yl]-4-oxo-butyric acid
[CAS# 332390-97-3]

Identification

• Name: 4-[5-(4-Methoxy-phenyl)-3-thiophen-2-yl-4,5-dihydro-pyrazol-1-yl]-4-oxo-butyric acid
• Molecular Formula: C₁₈H₁₇N₂O₄S
• Molecular Weight: 357.40
• CAS Registry Number: 332390-97-3
• SMILES: [C@H]1(N(N=C(C1)C2=CC=CS2)C(=O)CCC([O-])=O)C3=CC=C(OC)C=C3
• InChI: 1S/C18H18N2O4S/c1-24-13-6-4-12(5-7-13)15-11-14(16-3-2-10-25-16)19-20(15)17(21)8-9-18(22)23/h2-7,10,15H,8-9,11H2,1H3,(H,22,23)/p-1/t15-/m1/s1
• InChIKey: TUZVDXPPIAVVEF-OAHLLOKOSA-M

Properties

• Boiling point: 567.611°C at 760 mmHg (Cal.)
• Flash point: 297.081°C (Cal.)