2-(Trifluoromethyl)-4-pyrimidinecarboxamide
[CAS# 914348-10-0]

Identification

• Classification: Pharmaceutical intermediate >> Heterocyclic compound intermediate >> Pyrimidine compound >> Fluoropyrimidine
• Name: 2-(Trifluoromethyl)-4-pyrimidinecarboxamide
• Synonyms: 2-(Trifluoromethyl)pyrimidine-4-carboxamide; 2-Thiophen-2-ylquinoline-4-carboxylic acidhydrazide; 2-Trifluoromethylpyrimidine-4-carboxylic acid amide
• Molecular Formula: C₆H₄F₃N₃O
• Molecular Weight: 191.11
• CAS Registry Number: 914348-10-0
• SMILES: C1=CN=C(N=C1C(=O)N)C(F)(F)F
• InChI: 1S/C6H4F3N3O/c7-6(8,9)5-11-2-1-3(12-5)4(10)13/h1-2H,(H2,10,13)
• InChIKey: LBNILUATVOCQRF-UHFFFAOYSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Boiling point: 254.9±40.0°C at 760 mmHg (Cal.)
• Flash point: 108.0±27.3°C (Cal.)
• Refractive index: 1.479 (Cal.)

Safety Data

• Safety Code: S26;S37
• Risk Code: R36/37/38
• Hazard Symbol: X
• Safety Description: Irritant