AG003C6L

944451-24-5 | Chloro{(R)-(+)-2,2'-bis[di(3,5-xylyl)phosphino]-1,1'-binaphthyl}(p-cymene)ruthenium(II) chloride

AG003C6L

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CAS Number	944451-24-5
Catalog Number	AG003C6L(AGN-PC-0W41RH)
Chemical Name	Chloro{(R)-(+)-2,2'-bis[di(3,5-xylyl)phosphino]-1,1'-binaphthyl}(p-cymene)ruthenium(II) chloride
IUPAC Name	[1-[2-bis(3,5-dimethylphenyl)phosphanylnaphthalen-1-yl]naphthalen-2-yl]-bis(3,5-dimethylphenyl)phosphane;dichlororuthenium;1-methyl-4-propan-2-ylbenzene
InChI	InChI=1S/C52H48P2.C10H14.2ClH.Ru/c1-33-21-34(2)26-43(25-33)53(44-27-35(3)22-36(4)28-44)49-19-17-41-13-9-11-15-47(41)51(49)52-48-16-12-10-14-42(48)18-20-50(52)54(45-29-37(5)23-38(6)30-45)46-31-39(7)24-40(8)32-46;1-8(2)10-6-4-9(3)5-7-10;;;/h9-32H,1-8H3;4-8H,1-3H3;2*1H;/q;;;;+2/p-2
InChI Key	CBZXDZCPCDMKJU-UHFFFAOYSA-L
MDL Number	MFCD09753015
Molecular Formula	C62H60Cl2P2Ru
Molecular Weight	1039.0633
SMILES	C[Ru+](Cl)(C)C.Cc1cc(C)cc(c1)P(c1ccc2c(c1c1c(ccc3c1cccc3)P(c1cc(C)cc(c1)C)c1cc(C)cc(c1)C)cccc2)c1cc(C)cc(c1)C.Cc1ccc(cc1)C(C)C.[Cl-]
Synonyms	(R)-RuCl[(p-cymene)(DM-BINAP)]Cl, [RUCL(P-CYMENE)((S)-XYLBINAP)]CL, 944451-24-5, C62H62Cl2P2Ru, [RuCl(p-cymene)((R)-xylbinap}]Cl, MFCD09753015, 944451-25-6, [RUCL(P-CYMENE)((R)-XYLBINAP)]CL, CHLORO[(R)-(+)-2,2'-BIS[DI(3,5-XYLYL)PHOSPHINO]-1,1'-BINAPHTHYL](P-CYMENE)RUTHENIUM(II) CHLORIDE, CHLORO[(S)-(-)-2,2'-BIS[DI(3,5-XYLYL)PHOSPHINO]-1,1'-BINAPHTHYL](P-CYMENE)RUTHENIUM(II) CHLORIDE, Chloro{(R)-(+)-2,2'-bis[di(3,5-xylyl)phosphino]-1,1'-binaphthyl}(p-cymene)ruthenium(II) chloride, Chloro{(S)-(-)-2,2'-bis[di(3,5-xylyl)phosphino]-1,1'-binaphthyl}(p-cymene)ruthenium(II) chloride, CBZXDZCPCDMKJU-UHFFFAOYSA-L, [RuCl(p-cymene) ((S)-xylbinap)]Cl, SC10125, Chloro[(R)-(?)-2,2?-bis(di-(3,5-xylyl)phosphino)-1, [1-[2-bis(3,5-dimethylphenyl)phosphanylnaphthalen-1-yl]naphthalen-2-yl]-bis(3,5-dimethylphenyl)phosphane,dichlororuthenium,1-methyl-4-propan-2-ylbenzene, Chloro{(R)-(+)-2,2'-bis[di(3,5-xylyl)phosphino]-1,1'-binaphthyl}(p-cymene)ruthenium(II) chloride, [RuCl(p-cymene)((R)-xylbinap)]Cl, (S)-RuCl[(p-cymene)(DM-BINAP)]Cl, 1?-binaphthyl](p-cymene)ruthenium(II) chloride,

Complexity	1090
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	3
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	1040.275g/mol
Formal Charge	0
Heavy Atom Count	67
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	1041.096g/mol
Monoisotopic Mass	1040.275g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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