AG0036US

905459-27-0 | (SP-4-1)-[1,3-Bis[2,6-bis(1-methylethyl)phenyl]-1,3-dihydro-2H-imidazol-2-ylidene]dichloro(3-chloropyridine-κN)palladium

AG0036US

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CAS Number	905459-27-0
Catalog Number	AG0036US(AGN-PC-0VQQIH)
Chemical Name	(SP-4-1)-[1,3-Bis[2,6-bis(1-methylethyl)phenyl]-1,3-dihydro-2H-imidazol-2-ylidene]dichloro(3-chloropyridine-κN)palladium
IUPAC Name	1,3-bis[2,6-di(propan-2-yl)phenyl]-2H-imidazole;3-chloropyridine;dichloropalladium
InChI	InChI=1S/C27H38N2.C5H4ClN.2ClH.Pd/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;6-5-2-1-3-7-4-5;;;/h9-16,18-21H,17H2,1-8H3;1-4H;2*1H;/q;;;;+2/p-2
InChI Key	BLDKGTGQENJFON-UHFFFAOYSA-L
MDL Number	MFCD08457656
Molecular Formula	C32H40Cl3N3Pd
Molecular Weight	679.4591
SMILES	ClC1=CC=C[N](=C1)[Pd+4]([Cl-])([Cl-])=[C-2]2N(C=CN2C=3C(=CC=CC3C(C)C)C(C)C)C=4C(=CC=CC4C(C)C)C(C)C
Synonyms	905459-27-0, [1,3-Bis(2,6-Diisopropylphenyl)imidazol-2-ylidene](3-chloropyridyl)palladium(II) dichloride, 927706-57-8, PEPPSI-SIPR, (1,3-Bis(2,6-diisopropylphenyl)imidazolidene) ( 3-chloropyridyl) palladium(II) dichloride, (1,3-Bis(2,6-diisopropylphenyl)imidazolidene) ( 3-chloropyridyl) palladium(II) dichloride, (1,3-BIS(2,6-DIISOPROPYLPHENYL)IMIDAZOLIDENE) (3-CHLOROPYRIDYL) PALLADIUM(II) DICHLORIDE, (1,3-Bis(2,6-Diisopropylphenyl)imidazol-2-ylidene)(3-chloropyridyl)palladium(II) dichloride, 1,3-bis[2,6-di(propan-2-yl)phenyl]-2H-imidazole;3-chloropyridine;dichloropalladium, PEPPSI(TM)-IPR, C32H42Cl3N3Pd, PEPPSI(TM)-IPr catalyst, PEPPSI™-IPr catalyst, BLDKGTGQENJFON-UHFFFAOYSA-L, KS-00000X3A, PEPPSI(TM)-IPr catalyst, 98%, 5071AC, AKOS024259162, PEPPSI™-IPr impregnated tablets, SC10558, AK110575, ST2407801, PEPPSI™-IPr, ChemDose™ tablets, PEPPSI(TM)-IPr, ChemDose(TM) tablets, Loading: 2mumol per tablet, (1,3-bis(2,6-diisopropylphenyl)imidazolidene)(3-chloropyridyl)palladium(ii)dichloride, DICHLORO-[1,3-BIS(DIISOPROPYLPHENYL)IMIDAZOLYLIDENE]-(3-CHLOROPYRIDYL)PALLADIUM(II), [1,3-BIS(2,6-DIISOPROPYLPHENYL)IMIDAZOL-2-YLIDENE]-(3-CHLOROPYRIDYL)PALLADIUM(II) DICHLORIDE, ChemDose™, [1,3-Bis(2,6-diisopropylphenyl)imidazol-2-ylidene] (3-chloropyridyl)palladium(II) dichloride impregnated tablets, PEPPSI(TM)-SIPr catalyst, (1,3-Bis(2,6-diisopropylphenyl)imidazolidene)(3-chloropyridyl)palladium(II) dichloride,

Complexity	516
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	3
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	679.148g/mol
Formal Charge	0
Heavy Atom Count	39
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	681.479g/mol
Monoisotopic Mass	679.148g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	19.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302-H312-H332
Packing Group	\N
Precautionary statements	P280
UN Code	\N

Certificate of Analysis

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