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4,13-Diaza-18-crown 6-Ether

Catalog Number
ACM23978554-1
CAS Number
23978-55-4
Product Name
4,13-Diaza-18-crown 6-Ether
Structure
Category
Macrocycles; Supramolecular Host Materials
IUPAC Name
1,4,10,13-tetraoxa-7,16-diazacyclooctadecane
Molecular Weight
262.35g/mol
Molecular Formula
C12H26N2O4
Canonical SMILES
C1COCCOCCNCCOCCOCCN1
InChI
InChI=1S/C12H26N2O4/c1-5-15-9-10-17-7-3-14-4-8-18-12-11-16-6-2-13-1/h13-14H,1-12H2
InChI Key
NLMDJJTUQPXZFG-UHFFFAOYSA-N
Application
4,13-Diaza-18-crown 6-Ether is an off-white, shiny crystalline powder known for its role as a crown ether. It is primarily used in various scientific and chemical applications, such as investigating its complex-forming reactions with iodine through spectroscopic studies. Additionally, it serves as a crucial component in synthesizing specific ligands, like 7,16-bis(5-t-butyl-2-hydroxybenzyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane. Moreover, 4,13-Diaza-18-crown 6-Ether acts as a ligand in exploring zirconium-facilitated hydrolysis of dipeptides under neutral pH conditions, highlighting its versatility and importance in advanced chemical research.
Complexity
138
Covalently-Bonded Unit Count
1
EC Number
245-965-0
Exact Mass
262.189257g/mol
Formal Charge
0
Heavy Atom Count
18
MeSH Entry Terms
1,4,10,13-tetraoxa-7,16-diaza-cyclooctadecane;cryptand 2.2;K22 diaza-crown ether;Kryptofix 22
Monoisotopic Mass
262.189257g/mol
NSC Number
339325
Rotatable Bond Count
0
UNII
XLY51T1RSZ
XLogP3
-1.4
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