[1,3-Bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]-[2-[[(2-methylphenyl)imino] methyl]phenolyl]-[3-phenyl-1H-inden-1-ylidene]ruthenium(II) chloride

• CAS: 934538-12-2
• Catalog Number: ACM934538122-1
• Category: Ruthenium series catalysts
• Molecular Weight: 843.5
• Molecular Formula: C50H48ClN3ORu
• Synonyms: [1,3-Bis(2,4,6-trimethylphenyl)imidazolidin-2-ylidene]-(3-phenylinden-1-ylidene)ruthenium;6-[(2-methylanilino)methylidene]cyclohexa-2,4-dien-1-one;chloride
• IUPAC Name: [1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ylidene]-(3-phenylinden-1-ylidene)ruthenium;(6Z)-6-[(2-methylanilino)methylidene]cyclohexa-2,4-dien-1-one;chloride
• Canonical SMILES: CC1=CC=CC=C1NC=C2[C-]=CC=CC2=O.CC1=CC(=C(C(=C1)C)N2CCN(C2=[Ru]=C3C=C(C4=CC=CC=C43)C5=CC=CC=C5)C6=C(C=C(C=C6C)C)C)C.[Cl-]
• InChI: InChI=1S/C21H26N2.C15H10.C14H12NO.ClH.Ru/c1-14-9-16(3)20(17(4)10-14)22-7-8-23(13-22)21-18(5)11-15(2)12-19(21)6;1-2-6-12(7-3-1)15-11-10-13-8-4-5-9-14(13)15;1-11-6-2-4-8-13(11)15-10-12-7-3-5-9-14(12)16;/h9-12H,7-8H2,1-6H3;1-9,11H;2-6,8-10,15H,1H3;1H;/q;-1;/p-1
• InChI Key: YDFNHYNMJWHGME-UHFFFAOYSA-M
• Appearance: Solid
• Application: Highly active catalyst for ring opening and ring closing metathesis reactions.
• Complexity: 1460
• Covalently-Bonded Unit Count: 3
• Defined Bond Stereocenter Count: 1
• Exact Mass: 843.252931
• Formal Charge: -2
• H-Bond Acceptor: 6
• H-Bond Donor: 1
• Heavy Atom Count: 56
• Hydrogen Bond Acceptor Count: 6
• Hydrogen Bond Donor Count: 1
• Monoisotopic Mass: 843.252931
• Rotatable Bond Count: 5
• Topological Polar Surface Area: 35.6 Ų

Custom Reviews

January 20, 2023

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Highly effective catalyst
In catalytic experiments, [1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]-[2-[[(2-methylphenyl)imino] methyl]phenolyl]-[3-phenyl-1H-inden-1-ylidene]ruthenium(II) chloride can be used as a highly active catalyst for ring-opening and ring-closing metathesis reactions.