Chloro[tris(2,4-di-tert-butylphenyl)phosphite]gold

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Catalog Number
ACM915299240-1
Product Name
Chloro[tris(2,4-di-tert-butylphenyl)phosphite]gold
Structure
Structure
CAS
915299-24-0
Category
Gold series of catalysts
Synonyms
[Tris(2,4-di-tert-butylphenyl)phosphite]gold chloride
IUPAC Name
chlorogold;tris(2,4-ditert-butylphenyl) phosphite;
Molecular Weight
879.3
Molecular Formula
C42H63AuClO3P
Canonical SMILES
CC(C)(C)C1=CC(=C(C=C1)OP(OC2=C(C=C(C=C2)C(C)(C)C)C(C)(C)C)OC3=C(C=C(C=C3)C(C)(C)C)C(C)(C)C)C(C)(C)C.Cl[Au]
InChI
InChI=1S/C42H63O3P.Au.ClH/c1-37(2,3)28-19-22-34(31(25-28)40(10,11)12)43-46(44-35-23-20-29(38(4,5)6)26-32(35)41(13,14)15)45-36-24-21-30(39(7,8)9)27-33(36)42(16,17)18;/h19-27H,1-18H3;1H/q;+1;/p-1
InChI Key
GCWCLHMEYZKZRO-UHFFFAOYSA-M
Melting Point
200-202 °C
Complexity
825
Covalently-Bonded Unit Count
2
Exact Mass
878.386906
H-Bond Acceptor
3
Heavy Atom Count
48
Hydrogen Bond Acceptor Count
3
Hydrogen Bond Donor Count
0
Monoisotopic Mass
878.386906
Rotatable Bond Count
12
Topological Polar Surface Area
27.7 Ų
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