AG003CBV

374067-50-2 | (R)-Ru(OAc)2(DM-BINAP)

AG003CBV

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CAS Number	374067-50-2
Catalog Number	AG003CBV(AGN-PC-0RDUF9)
Chemical Name	(R)-Ru(OAc)2(DM-BINAP)
IUPAC Name	acetic acid;[1-[2-bis(3,5-dimethylphenyl)phosphanylnaphthalen-1-yl]naphthalen-2-yl]-bis(3,5-dimethylphenyl)phosphane;ruthenium
InChI	InChI=1S/C52H48P2.2C2H4O2.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;2*1-2(3)4;/h9-32H,1-8H3;2*1H3,(H,3,4);
InChI Key	HDUAMHMUQGCXCT-UHFFFAOYSA-N
MDL Number	MFCD09753022
Molecular Formula	C56H56O4P2Ru
Molecular Weight	956.0590
SMILES	CC1=O[Ru+2]23(P(C4=CC(C)=CC(C)=C4)(C5=CC(C)=CC(C)=C5)C6=CC=C(C=CC=C7)C7=C6C8=C(C=CC=C9)C9=CC=C8P2(C%10=CC(C)=CC(C)=C%10)C%11=CC(C)=CC(C)=C%11)([O-]C(C)=O3)[O-]1
Synonyms	(S)-Ru(OAc)2(DM-BINAP), (R)-Ru(OAc)2(DM-BINAP), 374067-49-9, MFCD09753022, 374067-50-2, DIACETATO[(R)-(+)-2,2'-BIS[DI(3,5-XYLYL)PHOSPHINO]-1,1'-BINAPHTHYL]RUTHENIUM(II), DIACETATO[(S)-(-)-2,2'-BIS[DI(3,5-XYLYL)PHOSPHINO]-1,1'-BINAPHTHYL]RUTHENIUM(II), C56H54O4P2Ru, RU(OAC)2[(R)-XYLBINAP], RU(OAC)2[(S)-XYLBINAP], Ru[(S)-DM-BINAP](OCOCH3)2, SC10150, DIACETATO[(R)-2,2'-BIS[DI(3,5-XYLYL)PHOSPHINO]-1,1'-BINAPHTHYL]RUTHENIUM(II), Diacetato[(S)-(?)-2,2?-bis[di(3,5-xylyl)phosphino]-1,1??binaphthyl]ruthenium(II), [1-[2-bis(3,5-dimethylphenyl)phosphanyl-1-naphthyl]-2-naphthyl]-b Is(3,5-dimethylphenyl)phosphane; Diacetoxyruthenium, Diacetato[(R)-2,2 inverted exclamation marka-bis[di(3,5-xylyl)phosphino]-1,1 inverted exclamation marka-binaphtyl]ruthenium(II), Diacetato[(S)-(-)-2,2 inverted exclamation marka-bis[di(3,5-xylyl)phosphino]-1,1 inverted exclamation marka-binaphthyl]ruthenium(II), Diacetato{(R)-(+)-2,2'-bis[di(3,5-xylyl)phosphino]-1,1'-binaphthyl}ruthenium(II), ?Ru(OAc)2[(R)-xylbinap], Diacetato{ - -2,2'-bis[di phosphino]-1,1'-binaphthyl}ruthenium,

Complexity	1080
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	4
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	956.27g/mol
Formal Charge	0
Heavy Atom Count	63
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	956.078g/mol
Monoisotopic Mass	956.27g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	74.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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