Methanesulfonato[[4-(N,N-dimethylamino)phenyl]di-tert-butylphosphino](2'-amino-1,1'-biphenyl-2-yl)palladium(II)

Catalog Number	ACM1820817648-1
CAS	1820817-64-8
Structure
Synonyms	4-Ditert-butylphosphanyl-N,N-dimethylaniline;methanesulfonic acid;palladium;2-phenylaniline
Molecular Weight	636.1
Molecular Formula	C29H42N2O3PPdS
Canonical SMILES	CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C.CS(=O)(=O)O.C1=CC=C([C-]=C1)C2=CC=CC=C2N.[Pd]
InChI	InChI=1S/C16H28NP.C12H10N.CH4O3S.Pd/c1-15(2,3)18(16(4,5)6)14-11-9-13(10-12-14)17(7)8;13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;1-5(2,3)4;/h9-12H,1-8H3;1-6,8-9H,13H2;1H3,(H,2,3,4);/q;-1;
InChI Key	OXTAAFWYZNPFBD-UHFFFAOYSA-N
Melting Point	192-201 °C
Purity	98%
Appearance	Powder
Exact Mass	635.16886
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
Monoisotopic Mass	635.16886
Rotatable Bond Count	5
Topological Polar Surface Area	92 Ų