1,4,5,6-Tetrahydro-1-(4-Chlorophenyl)-3-Cyclopentapyrazoleacetic Acid
[CAS# 21484-54-8]

Identification

• Name: 1,4,5,6-Tetrahydro-1-(4-Chlorophenyl)-3-Cyclopentapyrazoleacetic Acid
• Synonyms: 2-[1-(4-Chlorophenyl)-5,6-Dihydro-4H-Cyclopenta[D]Pyrazol-3-Yl]Ethanoic Acid; 1,4,5,6-Tetrahydro-1-(P-Chlorophenyl)-3-Cyclopentapyrazoleacetic Acid; 3-Cyclopentapyrazoleacetic Acid, 1,4,5,6-Tetrahydro-1-(P-Chlorophenyl)-
• Molecular Formula: C₁₄H₁₃ClN₂O₂
• Molecular Weight: 276.72
• CAS Registry Number: 21484-54-8
• SMILES: C3=C([N]1N=C(C2=C1CCC2)CC(=O)O)C=CC(=C3)Cl
• InChI: 1S/C14H13ClN2O2/c15-9-4-6-10(7-5-9)17-13-3-1-2-11(13)12(16-17)8-14(18)19/h4-7H,1-3,8H2,(H,18,19)
• InChIKey: XWEWKRMDHSSBML-UHFFFAOYSA-N

Properties

• Density: 1.442g/cm³ (Cal.)
• Boiling point: 454.569°C at 760 mmHg (Cal.)
• Flash point: 228.715°C (Cal.)