1,4,5,6-Tetrahydro-1-Phenyl-3-Cyclopentapyrazoleacetic Acid
[CAS# 21484-52-6]

Identification

• Name: 1,4,5,6-Tetrahydro-1-Phenyl-3-Cyclopentapyrazoleacetic Acid
• Synonyms: 2-(1-Phenyl-5,6-Dihydro-4H-Cyclopenta[D]Pyrazol-3-Yl)Ethanoic Acid; 1,4,5,6-Tetrahydro-1-Phenyl-3-Cyclopentapyrazoleacetic Acid; 3-Cyclopentapyrazoleacetic Acid, 1,4,5,6-Tetrahydro-1-Phenyl-
• Molecular Formula: C₁₄H₁₄N₂O₂
• Molecular Weight: 242.28
• CAS Registry Number: 21484-52-6
• SMILES: C3=C([N]1N=C(C2=C1CCC2)CC(=O)O)C=CC=C3
• InChI: 1S/C14H14N2O2/c17-14(18)9-12-11-7-4-8-13(11)16(15-12)10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H2,(H,17,18)
• InChIKey: WTMWGZQAMBPICC-UHFFFAOYSA-N

Properties

• Density: 1.327g/cm³ (Cal.)
• Boiling point: 432.835°C at 760 mmHg (Cal.)
• Flash point: 215.571°C (Cal.)