1-(4-Fluorobenzyl)-3-methyl-1H-pyrazole-5-carboxylic acid
[CAS# 618070-43-2]

Identification

• Name: 1-(4-Fluorobenzyl)-3-methyl-1H-pyrazole-5-carboxylic acid
• Synonyms: 1-(4-Fluorbenzyl)-3-methyl-1H-pyrazol-carbons??ure; 1-(4-Fluorbenzyl)-3-methyl-1H-pyrazol-carbonsäure; 1-(4-Fluorbenzyl)-3-methyl-1H-pyrazol-carbonsäure
• Molecular Formula: C₁₂H₁₁FN₂O₂
• Molecular Weight: 234.23
• CAS Registry Number: 618070-43-2
• SMILES: CC1=NN(C(=C1)C(=O)O)CC2=CC=C(C=C2)F
• InChI: 1S/C12H11FN2O2/c1-8-6-11(12(16)17)15(14-8)7-9-2-4-10(13)5-3-9/h2-6H,7H2,1H3,(H,16,17)
• InChIKey: LCNKEPNSKFFGPO-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 429.9±40.0°C at 760 mmHg (Cal.)
• Flash point: 213.8±27.3°C (Cal.)
• Refractive index: 1.591 (Cal.)