Acetic acid;[1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane;ruthenium

Catalog Number	ACM104713033-1
CAS	104713-03-3
Synonyms	(R)-Ru(OAc)2(BINAP)
Molecular Weight	843.8
Molecular Formula	C48H40O4P2Ru
Canonical SMILES	CC(=O)O.CC(=O)O.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=C(C4=CC=CC=C4C=C3)C5=C(C=CC6=CC=CC=C65)P(C7=CC=CC=C7)C8=CC=CC=C8.[Ru]
InChI	InChI=1S/C44H32P2.2C2H4O2.Ru/c1-5-19-35(20-6-1)45(36-21-7-2-8-22-36)41-31-29-33-17-13-15-27-39(33)43(41)44-40-28-16-14-18-34(40)30-32-42(44)46(37-23-9-3-10-24-37)38-25-11-4-12-26-38;2*1-2(3)4;/h1-32H;2*1H3,(H,3,4);
InChI Key	XANQJWCSQJDBEA-UHFFFAOYSA-N
Exact Mass	844.144524
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Monoisotopic Mass	844.144524
Rotatable Bond Count	7
Topological Polar Surface Area	74.6 Ų