Methanesulfonato{(R)-(-)-1-[(S)-2-(dicyclohexylphosphino)ferrocenyl]ethyldi-t-butylphosphine}(2'-amino-1,1'-biphenyl-2-yl)palladium(II), min. 98% [Josiphos Palladacycle Gen. 3]

• CAS: 1702311-34-9
• Catalog Number: ACM1702311349
• Category: Organic Phosphine Compounds
• Molecular Weight: 925.3g/mol
• Molecular Formula: C45H66FeNO3P2PdS-
• Synonyms: Bruno Palladacycle;Josiphos SL-J009-1 Pd G3;MFCD27978424;Josiphos SL-J009-2-G3-palladacycle, AldrichCPR;1702311-34-9;Methanesulfonato[(R)-(-)-1-[(S)-2-(dicyclohexylphosphino)ferrocenyl]ethyldi-t-butylphosphine](2'-amino-1,1'-biphenyl-2-yl)palladium(II)
• IUPAC Name: cyclopentane;ditert-butyl-[(1S)-1-(2-dicyclohexylphosphanylcyclopentyl)ethyl]phosphane;iron;methanesulfonic acid;palladium;2-phenylaniline
• Canonical SMILES: CC([C]1[CH][CH][CH][C]1P(C2CCCCC2)C3CCCCC3)P(C(C)(C)C)C(C)(C)C.CS(=O)(=O)O.C1=CC=C([C-]=C1)C2=CC=CC=C2N.[CH]1[CH][CH][CH][CH]1.[Fe].[Pd]
• InChI: InChI=1S/C27H47P2.C12H10N.C5H5.CH4O3S.Fe.Pd/c1-21(29(26(2,3)4)27(5,6)7)24-19-14-20-25(24)28(22-15-10-8-11-16-22)23-17-12-9-13-18-23;13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;1-2-4-5-3-1;1-5(2,3)4;;/h14,19-23H,8-13,15-18H2,1-7H3;1-6,8-9H,13H2;1-5H;1H3,(H,2,3,4);;/q;-1;;;;/t21-;;;;;/m0...../s1
• InChI Key: INJPONIANSCTIE-DHOIFHORSA-N
• Application: Catalyst used for C-O coupling reactions between electron-deficient phenols and functionalized heteroaryl chlorides.
• Complexity: 916
• Covalently-Bonded Unit Count: 6
• Defined Atom Stereocenter Count: 1
• Exact Mass: 924.262g/mol
• Formal Charge: -1
• H-Bond Acceptor: 5
• H-Bond Donor: 2
• Heavy Atom Count: 54
• Monoisotopic Mass: 924.262g/mol
• Rotatable Bond Count: 8
• Topological Polar Surface Area: 88.8A^2