Methanesulfonato(tri-t-butylphosphino)(2'-amino-1,1'-biphenyl-2-yl)palladium(II)

Catalog Number	ACM1445086178-1
CAS	1445086-17-8
Synonyms	P(t-Bu)3 Palladacycle Gen. 3
Molecular Weight	573.1
Molecular Formula	C25H41NO3PPdS
Canonical SMILES	CC(C)(C)P(C(C)(C)C)C(C)(C)C.CS(=O)(=O)O.C1=CC=C([C-]=C1)C2=CC=CC=C2N.[Pd]
InChI	InChI=1S/C12H10N.C12H27P.CH4O3S.Pd/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;1-10(2,3)13(11(4,5)6)12(7,8)9;1-5(2,3)4;/h1-6,8-9H,13H2;1-9H3;1H3,(H,2,3,4);/q-1;
InChI Key	VAPGTFWFXFUELK-UHFFFAOYSA-N
Purity	98%
Appearance	White to light brown powder
Complexity	577
Covalently-Bonded Unit Count	4
Defined Atom Stereocenter Count	0
Exact Mass	572.15796
Heavy Atom Count	32
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Monoisotopic Mass	572.15796
Rotatable Bond Count	4
Topological Polar Surface Area	88.8 Ų