4-(3,5-Dibromophenyl)-2,6-diphenylpyrimidine

• CAS: 607740-08-9
• Catalog Number: ACM607740089
• Category: Other Products
• Molecular Weight: 466.18
• Molecular Formula: C22H14Br2N2
• IUPAC Name: 4-(3,5-dibromophenyl)-2,6-diphenylpyrimidine
• Canonical SMILES: C1=CC=C(C=C1)C2=CC(=NC(=N2)C3=CC=CC=C3)C4=CC(=CC(=C4)Br)Br
• InChI: InChI=1S/C22H14Br2N2/c23-18-11-17(12-19(24)13-18)21-14-20(15-7-3-1-4-8-15)25-22(26-21)16-9-5-2-6-10-16/h1-14H
• InChI Key: DLXBSWIBLRUGFU-UHFFFAOYSA-N
• Melting Point: 199 °C
• Density: 1.532
• Appearance: White to Almost white powder to crystal
• Complexity: 424
• Covalently-Bonded Unit Count: 1
• Exact Mass: 465.95032g/mol
• Formal Charge: 0
• Hazard Statements: H315 : Causes skin irritation.H319 : Causes serious eye irritation.
• H-Bond Acceptor: 2
• H-Bond Donor: 0
• Heavy Atom Count: 26
• MDL Number: MFCD16619323
• Monoisotopic Mass: 463.95237g/mol
• Precautionary Statements: P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.
• Rotatable Bond Count: 3
• Signal Word: Warning
• XLogP3: 6.6