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Di(1-adamantyl)-n-butylphosphine - GC:80%, high purity , CAS No.321921-71-5

    Grade & Purity:
  • ≥80%
In stock
Item Number
D597564
Grouped product items
SKU Size
Availability
Price Qty
D597564-5g
5g
2
$380.90
D597564-25g
25g
1
$1,620.90

Basic Description

Synonyms 321921-71-5 | BUTYLDI-1-ADAMANTYLPHOSPHINE | Di(adamantan-1-yl)(butyl)phosphine | bis(1-adamantyl)-butylphosphane | Di(1-adamantyl)-n-butylphosphine | butyl di-1-adamantylphosphine | CATACXIUM A | Bis(1-adamantyl)-butyl-phosphane | Butyldi(1-adamantanyl)phosphine | Bis(ada
Specifications & Purity ≥80%
Storage Temp Store at 2-8°C,Argon charged
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Product Description

 di-adamantylalkylphosphine is a bulky and electron-rich phosphine ligand that is highly effective for palladium catalyzed cross-coupling reactions such as Heck and Suzuki coupling, Buchwald-Hartwig amination of aryl chlorides, and α-arylation reactions of ketones.

Other applications:

· palladium-catalyzed carbonylation of aryl and heteroaryl halides 

· palladium-catalyzed synthesis of (hetero)aromatic nitriles

· palladium-catalyzed aminocarbonylation of aryl halides

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Organophosphorus compounds
Class Organic phosphines and derivatives
Subclass Not available
Intermediate Tree Nodes Not available
Direct Parent Organic phosphines and derivatives
Alternative Parents Hydrocarbon derivatives  
Molecular Framework Aliphatic homopolycyclic compounds
Substituents Phosphine - Hydrocarbon derivative - Aliphatic homopolycyclic compound
Description This compound belongs to the class of organic compounds known as organic phosphines and derivatives. These are organic compounds containing a phosphine derivative, with the general formula B1P(R2)R3 (R1-R3=alkyl, aryl).
External Descriptors Not available

Names and Identifiers

IUPAC Name bis(1-adamantyl)-butylphosphane
INCHI InChI=1S/C24H39P/c1-2-3-4-25(23-11-17-5-18(12-23)7-19(6-17)13-23)24-14-20-8-21(15-24)10-22(9-20)16-24/h17-22H,2-16H2,1H3
InChIKey HTJWUNNIRKDDIV-UHFFFAOYSA-N
Smiles CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5
Isomeric SMILES CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5
WGK Germany 3
Molecular Weight 358.54
Reaxy-Rn 8726448
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8726448&ln=

Certificates(CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

3 results found

Lot Number Certificate Type Date Item
G2312044 Certificate of Analysis Jun 17, 2025 D597564
G2312042 Certificate of Analysis Jul 15, 2023 D597564
G2312043 Certificate of Analysis Jul 15, 2023 D597564

Chemical and Physical Properties

Melt Point(°C) 110-111°C
Molecular Weight 358.500 g/mol
XLogP3 6.500
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 0
Rotatable Bond Count 5
Exact Mass 358.279 Da
Monoisotopic Mass 358.279 Da
Topological Polar Surface Area 0.000 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 408.000
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
The total count of all stereochemical bonds 0
Covalently-Bonded Unit Count 1

Solution Calculators

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