Cas no 905709-79-7 ((R)-C3-TunePhos-ruthenium complex)

(R)-C3-TunePhos-ruthenium complex structure
905709-79-7 structure
Product Name:(R)-C3-TunePhos-ruthenium complex
CAS No:905709-79-7
MF:C49H46Cl2O2P2Ru
MW:900.811872959137
CID:2602485
PubChem ID:24884439
Update Time:2024-10-26

(R)-C3-TunePhos-ruthenium complex Chemical and Physical Properties

Names and Identifiers

    • (R)-C3-TUNEPHOS-RUTHENIUM COMPLEX
    • [Chloro(R)-C3-TunePhos)(p-cymene)ruthenium(II)] chloride
    • PUBCHEM_71310483
    • chlororuthenium(1+);(17-diphenylphosphanyl-8,12-dioxatricyclo[11.4.0.02,7]heptadeca-1(13),2(7),3,5,14,16-hexaen-3-yl)-diphenylphosphane;1-methyl-4-propan-2-ylbenzene;chloride
    • 905709-79-7
    • DTXSID90746203
    • (R)-C3-TunePhos-ruthenium complex
    • MDL: MFCD07782001
    • Inchi: 1S/C39H32O2P2.C10H14.2ClH.Ru/c1-5-16-30(17-6-1)42(31-18-7-2-8-19-31)36-26-13-24-34-38(36)39-35(41-29-15-28-40-34)25-14-27-37(39)43(32-20-9-3-10-21-32)33-22-11-4-12-23-33;1-8(2)10-6-4-9(3)5-7-10;;;/h1-14,16-27H,15,28-29H2;4-8H,1-3H3;2*1H;/q;;;;+2/p-2
    • InChI Key: BOERIKXMDOKSHH-UHFFFAOYSA-L
    • SMILES: [Ru+]Cl.[Cl-].P(C1C=CC=CC=1)(C1C=CC=CC=1)C1=CC=CC2=C1C1C(=CC=CC=1P(C1C=CC=CC=1)C1C=CC=CC=1)OCCCO2.C(C)(C)C1C=CC(C)=CC=1

Computed Properties

  • Exact Mass: 900.139350g/mol
  • Monoisotopic Mass: 900.139350g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 56
  • Rotatable Bond Count: 7
  • Complexity: 798
  • Covalently-Bonded Unit Count: 4
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 18.5

Experimental Properties

  • Melting Point: >300?°C

(R)-C3-TunePhos-ruthenium complex Security Information

  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3

(R)-C3-TunePhos-ruthenium complex Pricemore >>

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