2-[2-(5-Methylfuran-2-yl)vinyl]-4,6-bis(trichloromethyl)-1,3,5-triazine

• CAS: 156360-76-8
• Catalog Number: ACM156360768
• Category: Other Products
• Molecular Weight: 421.9g/mol
• Molecular Formula: C12H7Cl6N3O
• IUPAC Name: 2-[(E)-2-(5-methylfuran-2-yl)ethenyl]-4,6-bis(trichloromethyl)-1,3,5-triazine
• Canonical SMILES: CC1=CC=C(O1)C=CC2=NC(=NC(=N2)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl
• InChI: InChI=1S/C12H7Cl6N3O/c1-6-2-3-7(22-6)4-5-8-19-9(11(13,14)15)21-10(20-8)12(16,17)18/h2-5H,1H3/b5-4+
• InChI Key: XOPKKHCDIAYUSK-SNAWJCMRSA-N
• Complexity: 389
• Covalently-Bonded Unit Count: 1
• Exact Mass: 420.869078g/mol
• Formal Charge: 0
• H-Bond Acceptor: 4
• H-Bond Donor: 0
• Heavy Atom Count: 22
• Monoisotopic Mass: 418.872028g/mol
• Rotatable Bond Count: 2
• XLogP3: 5.1