XantPhos-Pd-G2

• Catalog Number: ACM1375325771
• Product Name: XantPhos-Pd-G2
• CAS: 1375325-77-1
• Category: Palladium series catalysts
• Synonyms: 1375325-77-1;Chloro[(4,5-bis(diphenylphosphino)-9,9-dimethyl xanthene)-2-(2-amino-1,1-biphenyl)]palladium(II);XantPhos-Pd-G2
• IUPAC Name: chloropalladium(1+);(5-diphenylphosphanyl-9,9-dimethylxanthen-4-yl)-diphenylphosphane;2-phenylaniline
• Molecular Weight: 888.721g/mol
• Molecular Formula: C51H42ClNOP2Pd
• Canonical SMILES: CC1(C2=C(C(=CC=C2)P(C3=CC=CC=C3)C4=CC=CC=C4)OC5=C1C=CC=C5P(C6=CC=CC=C6)C7=CC=CC=C7)C.C1=CC=C([C-]=C1)C2=CC=CC=C2N.Cl[Pd+]
• InChI: InChI=1S/C39H32OP2.C12H10N.ClH.Pd/c1-39(2)33-25-15-27-35(41(29-17-7-3-8-18-29)30-19-9-4-10-20-30)37(33)40-38-34(39)26-16-28-36(38)42(31-21-11-5-12-22-31)32-23-13-6-14-24-32;13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;;/h3-28H,1-2H3;1-6,8-9H,13H2;1H;/q;-1;;+2/p-1
• InChI Key: FAEFBQZYGQRYRN-UHFFFAOYSA-M
• Complexity: 1000
• Covalently-Bonded Unit Count: 3
• Exact Mass: 887.146g/mol
• H-Bond Acceptor: 3
• H-Bond Donor: 1
• Heavy Atom Count: 57
• Monoisotopic Mass: 887.146g/mol
• Rotatable Bond Count: 7
• Topological Polar Surface Area: 35.2A^2