Home Other Building Blocks 1,3,5,7-Tetramethyl-2,4,8-trioxa-6-phenyl-6-phosphaadamantane

1,3,5,7-Tetramethyl-2,4,8-trioxa-6-phenyl-6-phosphaadamantane

CAS No.:
97739-46-3
Catalog Number:
AG0036P6
Molecular Formula:
C16H21O3P
Molecular Weight:
292.3099
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Product Description
Catalog Number:
AG0036P6
Chemical Name:
1,3,5,7-Tetramethyl-2,4,8-trioxa-6-phenyl-6-phosphaadamantane
CAS Number:
97739-46-3
Molecular Formula:
C16H21O3P
Molecular Weight:
292.3099
MDL Number:
MFCD10567051
IUPAC Name:
1,3,5,7-tetramethyl-8-phenyl-2,4,6-trioxa-8-phosphatricyclo[3.3.1.13,7]decane
InChI:
InChI=1S/C16H21O3P/c1-13-10-15(3)19-14(2,17-13)11-16(4,18-13)20(15)12-8-6-5-7-9-12/h5-9H,10-11H2,1-4H3
InChI Key:
AVVSJWUWBATQBX-UHFFFAOYSA-N
SMILES:
CC12CC3(C)OC(P2c2ccccc2)(CC(O1)(O3)C)C
Properties
Complexity:
407  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.123g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
292.315g/mol
Monoisotopic Mass:
292.123g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
4  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Literature
Title Journal
Reversed-polarity synthesis of diaryl ketones via palladium-catalyzed cross-coupling of acylsilanes. Journal of the American Chemical Society 20111214
Synthesis of dibenzo[b,f][1,4]oxazepin-11(10H)-ones via intramolecular cyclocarbonylation reactions using PdI(2)/Cytop 292 as the catalytic system. The Journal of organic chemistry 20100917
Access to flavones via a microwave-assisted, one-pot Sonogashira-carbonylation-annulation reaction. Organic letters 20090806
Phenylphosphatrioxa-adamantanes: bulky, robust, electron-poor ligands that give very efficient rhodium(I) hydroformylation catalysts. Dalton transactions (Cambridge, England : 2003) 20050321
Palladium complexes of 1,3,5,7-tetramethyl-2,4,8-trioxa-6-phenyl-6-phosphaadamantane: synthesis, crystal structure and use in the Suzuki and Sonogashira reactions and the alpha-arylation of ketones. The Journal of organic chemistry 20040723
Novel class of tertiary phosphine ligands based on a phospha-adamantane framework and use in the Suzuki cross-coupling reactions of aryl halides under mild conditions. Organic letters 20030320
Properties