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

Catalog Number

ACM852445831

Product Name

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

Structure

CAS

852445-83-1

Category

Gold series of catalysts

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;

Molecular Weight

621.016g/mol

Molecular Formula

C27H36AuClN2;

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

MSDS

COA

Spec Sheet