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Structure

Bis[tris(4-(1H,1H,2H,2H-perfluorodecyl)phenyl)phosphine]palladium(II) dichloride

CAS
326475-46-1
Catalog Number
ACM326475461-1
Category
Other Products
Molecular Weight
3378.52
Molecular Formula
C56H30F63P;

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Specification

Synonyms
326475-46-1;Bis[tris(4-(1H,1H,2H,2H-perfluorodecyl)phenyl)phosphine]palladium(II) dichloride;dichloropalladium; tris[4-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)phenyl]phosphane;CTK8E9149;
IUPAC Name
1,1,1,2,2,3,3,4,4,5,5,8-dodecafluorooctane;tris[4-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)phenyl]phosphane;
Canonical SMILES
C1=CC(=CC=C1CCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)P(C2=CC=C(C=C2)CCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C3=CC=C(C=C3)CCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.C(CC(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)CF;
InChI
InChI=1S/C48H24F51P.C8H6F12/c49-25(50,28(55,56)31(61,62)34(67,68)37(73,74)40(79,80)43(85,86)46(91,92)93)16-13-19-1-7-22(8-2-19)100(23-9-3-20(4-10-23)14-17-26(51,52)29(57,58)32(63,64)35(69,70)38(75,76)41(81,82)44(87,88)47(94,95)96)24-11-5-21(6-12-24)15-18-27(53,54)30(59,60)33(65,66)36(71,72)39(77,78)42(83,84)45(89,90)48(97,98)99;9-3-1-2-4(10,11)5(12,13)6(14,15)7(16,17)8(18,19)20/h1-12H,13-18H2;1-3H2;
InChI Key
DIRZGJYLZNXQSU-UHFFFAOYSA-N;
Storage
room temperature
Complexity
2760
Covalently-Bonded Unit Count
2
Exact Mass
1930.108g/mol
H-Bond Acceptor
63
Heavy Atom Count
120
Monoisotopic Mass
1930.108g/mol
Rotatable Bond Count
36
Topological Polar Surface Area
0A^2
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