1,3-Di(adamantan-1-yl)-1H-imidazol-3-ium tetrafluoroborate

Name: 1,3-Di(adamantan-1-yl)-1H-imidazol-3-ium tetrafluoroborate
Brand: ChemScene
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CAS No. 286014-42-4
Cat. No. CS-W009680
Purity≥97%
MDL No.MFCD04973311

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

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1,3-Di(adamantan-1-yl)-1H-imidazol-3-ium tetrafluoroborate|CS-W009680

Structure of 286014-42-4

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Application

1,3-Di(adamantan-1-yl)-1H-imidazol-3-ium tetrafluoroborate serves as a sterically encumbered, bench-stable N-heterocyclic carbene precursor with enhanced solubility in organic media. Its robust adamantane moieties confer high thermal stability and resistance to decomposition, enabling reliable use in transition-metal-catalyzed cross-coupling reactions. The imidazolium salt facilitates efficient carbene generation under mild conditions and demonstrates broad functional group tolerance, making it well-suited for catalytic transformations requiring precise control and reproducibility in synthetic and process chemistry workflows.

General Information

CAS No. 286014-42-4
Cat. No. CS-W009680
Purity ≥97%
MDL No. MFCD04973311
Storage 4°C, protect from light, stored under nitrogen
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₂₃H₃₃BF₄N₂
Molecular Weight 424.33
Synonym(s) 1,3-ditricyclo[3.3.1.13,7]dec-1-yl-1H-imidazol-3-ium tetrafluoroborate
SMILES FB(F)F.[C@@H]1(C[C@@H]2C[C@@H](C3)C1)CC3(C2)[N+]4=CN(C=C4)C5(C[C@H]6C7)C[C@@H](C6)C[C@@H]7C5.[F-]

Computational Chemistry Data

TPSA 8.81
LogP 2.51
H_Acceptors 1
H_Donors 0
Rotatable_Bonds 2

Safety Information

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GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

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1,3-Di(adamantan-1-yl)-1H-imidazol-3-ium tetrafluoroborate

CAS No. 286014-42-4

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