AG003U5L

220114-38-5 | RuCl2[(R)DMBINAP][(R,R)DPEN]

AG003U5L

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CAS Number	220114-38-5
Catalog Number	AG003U5L(AGN-PC-0QYJU5)
Chemical Name	RuCl2[(R)DMBINAP][(R,R)DPEN]
IUPAC Name	[1-[2-bis(3,5-dimethylphenyl)phosphanylnaphthalen-1-yl]naphthalen-2-yl]-bis(3,5-dimethylphenyl)phosphane;dichlororuthenium;(1R,2R)-1,2-diphenylethane-1,2-diamine
InChI	InChI=1S/C52H48P2.C14H16N2.2ClH.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;15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12;;;/h9-32H,1-8H3;1-10,13-14H,15-16H2;2*1H;/q;;;;+2/p-2/t;13-,14-;;;/m.1.../s1
InChI Key	HYMSONXJNGZZBM-ODQAEMFESA-L
MDL Number	MFCD09753028
Molecular Formula	C66H64Cl2N2P2Ru
Molecular Weight	1119.1513
SMILES	[Cl-][Ru+2]7([NH2]C(C([NH2]%12)c%11ccccc%11)c%10ccccc%10)%12([Cl-])[P](c2cc(C)cc(C)c2)(c(cc4)c(c5c([P](c9cc(C)cc(C)c9)7c8cc(C)cc(C)c8)ccc6c5cccc6)c3c4cccc3)c1cc(C)cc(C)c1
Synonyms	RuCl2[(R)-DM-BINAP][(R,R)-DPEN], 220114-38-5, RUCL2[(R)-XYLBINAP][(R,R)-DPEN], Dichloro{(R)-(+)-2,2'-bis[di(3,5-xylyl)phosphino]-1,1'-binaphthyl}[(1R,2R)-(+)-1,2-diphenylethylenediamine]ruthenium(II), MFCD09753028, DICHLORO[(R)-(+)-2,2'-BIS[DI(3,5-XYLYL)PHOSPHINO]-1,1'-BINAPHTHYL][(1R,2R)-(+)-1,2-DIPHENYLETHYLENEDIAMINE]RUTHENIUM(II), C66H64Cl2N2P2Ru, CTK8E9379, DTXSID10585292, PUBCHEM_16220282, SC10172, (R)-DM-BINAP RuCl2 (R,R)-DPEN, RT-015462, RuCl2[(R)?DM?BINAP][(R,R)?DPEN], J-014422, Dichloro[(R)-2,2 inverted exclamation marka-bis[di(3,5-xylyl)phosphino]-1,1 inverted exclamation marka-binaphthyl][(1R,2R)-1,2-diphenylethylenediamine]ruthenium(II), DICHLORO[(R)-2,2'-BIS[DI(3,5-XYLYL)PHOSPHINO]-1,1'-BINAPHTHYL][(1R,2R)-1,2-DIPHENYLETHYLENEDIAMINE]RUTHENIUM(II), Dichloro[(R)?2,2??bis[di(3,5?xylyl)phosphino]?1,1??binaphthyl][(1R,2R)?1,2?diphenylethylenediamine]ruthenium(II), Dichloro{(R)-(+)-2,2'-bis[di(3,5-xylyl)phosphino]-1,1'-binaphthyl}[(1R,2R)-(+)-1,2-diphenylethylenediamine]Ru(II), Dichloro{(R)-(+)-2,2'-bis[di(3,5-xylyl)phosphino]-1,1'-binaphthyl}[(1R,2R)-(+)-1,2-diphenylethylenediamine]ruthenium(II), ?RuCl2[(R)-xylbinap][(R,R)-dpen], Dichloro{ - -2,2'-bis[di phosphino]-1,1'-binaphthyl}[ - -1,2-diphenylethylenediamine]ruthenium,

Complexity	1170
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	3
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	1118.297g/mol
Formal Charge	0
Heavy Atom Count	73
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	1119.17g/mol
Monoisotopic Mass	1118.297g/mol
Rotatable Bond Count	10
Topological Polar Surface Area	52A^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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