5-(4-(Trifluoromethyl)phenyl)pyrimidin-2-amine

• Catalog: OFC1111104892
• CAS: 1111104-89-2
• Category: Fluorinated Pyrimidines
• Synonyms: 2-Amino-5-(4-(trifluoromethyl)phenyl)pyrimidine
• Purity: 97%
• MDL Number: MFCD11877090

• IUPAC Name: 5-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine
• InChI: InChI=1S/C11H8F3N3/c12-11(13,14)9-3-1-7(2-4-9)8-5-16-10(15)17-6-8/h1-6H,(H2,15,16,17)
• InChI Key: ZVGUKOOPGKOHPF-UHFFFAOYSA-N
• Isomeric SMILES: C1=CC(=CC=C1C2=CN=C(N=C2)N)C(F)(F)F

• Molecular Formula: C11H8F3N3
• Molecular Weight: 239.20
• Storage: Keep in dark place, inert atmosphere, room temperature

• XLogP3-AA: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 239.06703175 g/mol
• Monoisotopic Mass: 239.06703175 g/mol
• Topological Polar Surface Area: 51.8Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 241