AG003AJ8

918870-76-5 | Ruthenium, [1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro[[5-[(dimethylamino)sulfonyl]-2-(1-methylethoxy-κO)phenyl]methylene-κC]-, (SP-5-41)-

AG003AJ8

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CAS Number	918870-76-5
Catalog Number	AG003AJ8(AGN-PC-0VWXCQ)
Chemical Name	Ruthenium, [1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro[[5-[(dimethylamino)sulfonyl]-2-(1-methylethoxy-κO)phenyl]methylene-κC]-, (SP-5-41)-
IUPAC Name	[1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ylidene]-dichloro-[[5-(dimethylsulfamoyl)-2-propan-2-yloxyphenyl]methylidene]ruthenium
InChI	InChI=1S/C21H26N2.C12H17NO3S.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;1-9(2)16-12-7-6-11(8-10(12)3)17(14,15)13(4)5;;;/h9-12H,7-8H2,1-6H3;3,6-9H,1-2,4-5H3;2*1H;/q;;;;+2/p-2
InChI Key	OXLURKCRXVAJQS-UHFFFAOYSA-L
MDL Number	MFCD08459353
Molecular Formula	C33H43Cl2N3O3RuS
Molecular Weight	733.7538
SMILES	[Cl-][Ru+6]1(=[C-2]2N(CCN2c2c(C)cc(cc2C)C)c2c(C)cc(cc2C)C)(=[CH-2]c2c([O]1C(C)C)ccc(c2)S(=O)(=O)N(C)C)[Cl-]
Synonyms	918870-76-5, Zhan Catalyst-1B, Dichloro(1,3-dimesityl-2-imidazolidinylidene)[5-(dimethylsulfamoy l)-2-isopropoxybenzylidene]ruthenium, [1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ylidene]-dichloro-[[5-(dimethylsulfamoyl)-2-propan-2-yloxyphenyl]methylidene]ruthenium, 1,3-Bis(2,4,6-trimethylphenyl)-4,5-dihydroimidazol-2-ylidene[2-(i-propoxy)-5-(N,N-dimethylaminosulfonyl)phenyl]methyleneruthenium (II) dichloride, Zhan Catalyst-1B, min 96%, 1,3-bis(2,4,6-trimethylphenyl)-4,5-dihydroimidazol-2-ylidene[2-(i-propoxy)-5-(n,n-dimethylaminosulfonyl)phenyl]methyleneruthenium(ii) dichloride, 1,3-bis-(2,4,6-Trimethylphenyl)-4,5-dihydroimidazol-2-ylidene[2-(i-propoxy)-5-(n,n-dimethylaminosulfonyl)phenyl]methyleneruthenium(II) dichloride, Dichloro[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene][[5-[(dimethylamino)sulfonyl]-2-(1-methylethoxy-O)phenyl]methylene-C]ruthenium(II), 1,3-Bis -4,5-dihydroimidazol-2-ylidene[2- -5- phenyl]methyleneruthenium dichloride,

Complexity	1130
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	733.144559g/mol
Formal Charge	0
Heavy Atom Count	43
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	733.8g/mol
Monoisotopic Mass	733.144559g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	61.5Ų
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P305+P351+P338
UN Code	\N

Certificate of Analysis

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