1,3-Bis(2,6-di-isopropylphenyl)imidazol-2-ylidenegold(I) chloride, 95%

• CAS: 852445-83-1
• Catalog Number: ACM852445831
• Category: Gold series of catalysts
• Molecular Weight: 621.016g/mol
• Molecular Formula: C27H36AuClN2
• Synonyms: 852445-83-1; SC10711; 1,3-Bis(2,6-diisopropylphenyl)imidazol-2-ylidene gold(I)chloride; {1,3-Bis[2,6-di(propan-2-yl)phenyl]-1,3-dihydro-2H-imidazol-2-ylidene}(chloro)gold; AKOS015951030; 1,3-Bis(2,6-diisopropylphenyl-imidazol-2-ylidene)gold(I) chloride; (1,3-Bis(2,6-diisopropylphenyl)-1,3-dihydro-2H-imidazol-2-ylidene)(chloro)gold
• IUPAC Name: [1,3-bis[2,6-di(propan-2-yl)phenyl]imidazol-2-ylidene]-chlorogold
• Canonical SMILES: CC(C)C1=C(C(=CC=C1)C(C)C)N2C=CN(C2=[Au]Cl)C3=C(C=CC=C3C(C)C)C(C)C
• InChI: InChI=1S/C27H36N2.Au.ClH/c1-18(2)22-11-9-12-23(19(3)4)26(22)28-15-16-29(17-28)27-24(20(5)6)13-10-14-25(27)21(7)8;;/h9-16,18-21H,1-8H3;;1H/q;+1;/p-1
• InChI Key: CNJQLSINQGKZAW-UHFFFAOYSA-M
• Application: Catalyst used for rearrangement of allylic acetates.; ; Catalyst used for alkane carbon-hydrogen bond functionalization.; ; Catalyst used for room temperature hydroamination of N-alkenyl ureas.; ; Catalyst used for hydration of alkynes.
• Storage: 2-8°C
• Complexity: 559
• Covalently-Bonded Unit Count: 1
• Exact Mass: 620.223g/mol
• H-Bond Acceptor: 2
• Heavy Atom Count: 31
• Monoisotopic Mass: 620.223g/mol
• Rotatable Bond Count: 6
• Topological Polar Surface Area: 6.5A^2