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Bis(3,5-di-tert-butyl-4-methoxyphenyl)chlorophosphine
PRICE INQUIRYCatalog Number
ACM212713081
Product Name
Bis(3,5-di-tert-butyl-4-methoxyphenyl)chlorophosphine
Structure
![{[CurrentData.Name]}](https://resource.alfachemic.com/structure/212713-08-1.gif)
CAS
212713-08-1
Synonyms
chlorobis(3,5-di-tert-butyl-4-methoxyphenyl)phosphine; ZINC100009641; ACMC-20alnq; Bis(3,5-di-t-butyl-4-methoxyphenyl)chlorophosphine; Phosphinous chloride,bis[3,5-bis(1,1-dimethylethyl)-4-methoxyphenyl]- (9CI); VOGHMZHRQUWLRE-UHFFFAOYSA-N; DTXSID20700292; SCHEMBL459830; DB-009597;
IUPAC Name
chloro-bis(3,5-ditert-butyl-4-methoxyphenyl)phosphane;
Molecular Weight
505.12g/mol
Molecular Formula
C30H46ClO2P;
Canonical SMILES
CC(C)(C)C1=CC(=CC(=C1OC)C(C)(C)C)P(C2=CC(=C(C(=C2)C(C)(C)C)OC)C(C)(C)C)Cl;
InChI
InChI=1S/C30H46ClO2P/c1-27(2,3)21-15-19(16-22(25(21)32-13)28(4,5)6)34(31)20-17-23(29(7,8)9)26(33-14)24(18-20)30(10,11)12/h15-18H,1-14H3;
InChI Key
VOGHMZHRQUWLRE-UHFFFAOYSA-N;
Complexity
547
Covalently-Bonded Unit Count
1
Exact Mass
504.292g/mol
H-Bond Acceptor
2
Heavy Atom Count
34
Monoisotopic Mass
504.292g/mol
Rotatable Bond Count
8
Topological Polar Surface Area
18.5A^2
Application
Bis(3,5-di-tert-butyl-4-methoxyphenyl)chlorophosphine serves as a crucial reactant in various advanced chemical processes. It plays a significant role in asymmetric hydrogenation when used with iridium catalysts and participates in chemoselective reactions involving deprotonated 2-hydroxy-3,3,N-trimethylbutanamide. Additionally, it is instrumental in the synthesis of phosphine-containing amino acids and peptide-based catalyst ligands. This compound is also vital for creating nonracemic phosphine-containing amino acids, which are essential in palladium-catalyzed asymmetric allylic substitution reactions.
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