Grubbs catalyst 2nd generation

• Catalog Number: ACM246047723-2
• Product Name: Grubbs catalyst 2nd generation
• CAS: 246047-72-3
• Category: Polymer/Macromolecule
• Synonyms: Tricyclohexylphosphine[1,3-bis(2,4,6-trimethylphenyl)-4,5-dihydroimidazol-2-ylidene][benzylidine]Ruthenium(IV)dichloride
• IUPAC Name: benzylidene-[1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ylidene]-dichlororuthenium;tricyclohexylphosphane
• Molecular Weight: 848.97
• Molecular Formula: C46H65Cl2N2PRu
• Canonical SMILES: CC1=CC(=C(C(=C1)C)N2CCN(C2=[Ru](=CC3=CC=CC=C3)(Cl)Cl)C4=C(C=C(C=C4C)C)C)C.C1CCC(CC1)P(C2CCCCC2)C3CCCCC3
• InChI: InChI=1S/C21H26N2.C18H33P.C7H6.2ClH.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;1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-7-5-3-2-4-6-7;/h9-12H,7-8H2,1-6H3;16-18H,1-15H2;1-6H;2*1H;/q;+2/p-2
• InChI Key: FCDPQMAOJARMTG-UHFFFAOYSA-L
• Melting Point: 143-148 °C
• Appearance: Powder
• Complexity: 927
• Covalently-Bonded Unit Count: 2
• Defined Atom Stereocenter Count: 0
• Exact Mass: 848.330583
• Hazard Statements: H228
• Heavy Atom Count: 52
• Hydrogen Bond Acceptor Count: 2
• Hydrogen Bond Donor Count: 0
• MDL Number: MFCD03453237
• Monoisotopic Mass: 848.330583
• Rotatable Bond Count: 6
• Safety Description: Warning
• Symbol: GHS02
• Topological Polar Surface Area: 6.5 Ų
• UN Number: UN 1325 4.1 / PGII