5-Formyl-2-methyl-4-(trifluoromethyl)-1H-pyrrole-3-carboxylic acid
[CAS# 945379-11-3]

Identification

• Name: 5-Formyl-2-methyl-4-(trifluoromethyl)-1H-pyrrole-3-carboxylic acid
• Synonyms: 5-formyl-2-methyl-4-(trifluoromethyl)-1H-pyrrole-3-carboxylic acid
• Molecular Formula: C₈H₆F₃NO₃
• Molecular Weight: 221.13
• CAS Registry Number: 945379-11-3
• SMILES: Cc1c(c(c([nH]1)C=O)C(F)(F)F)C(=O)O
• InChI: 1S/C8H6F3NO3/c1-3-5(7(14)15)6(8(9,10)11)4(2-13)12-3/h2,12H,1H3,(H,14,15)
• InChIKey: SMNKHSZKLLUFAY-UHFFFAOYSA-N

Properties

• Density: 1.56g/cm³ (Cal.)
• Boiling point: 360.731°C at 760 mmHg (Cal.)
• Flash point: 171.964°C (Cal.)
• Refractive index: 1.536 (Cal.)