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4',4''(5'')-DI-TERT-BUTYLDIBENZO-18-CROWN-6

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4',4''(5'')-DI-TERT-BUTYLDIBENZO-18-CROWN-6 Basic information

Product Name:
4',4''(5'')-DI-TERT-BUTYLDIBENZO-18-CROWN-6
Synonyms:
  • 4',4''(5'')-DI-TERT-BUTYLDIBENZO-18-CROWN-6
  • AR,AR'-DI-TERT-BUTYLDIBENZO-18-CROWN-6
  • 14)-bis(1,1-dimethylethyl)-ro-13(or2
  • 4',4''(5'')-di-tert-butyldibenzo-18-crown-6, mixed isomers
  • 4',4pi(5pi)-Di-tert-butyldibenzo-18-crown-6
  • 4,4'-Di-tert-butyldibenzo-18-crown-6
  • 4',4''(5'')-Di-tert-butyldibenzo-18-crown-6,94%
  • 4',4''(5'')-di-tert-butyldibenzo-18-crown-6, mixed iso
CAS:
29471-17-8
MF:
C28H40O6
MW:
472.61
Product Categories:
  • Crown Ethers
  • Chelation/Complexation Compounds
  • Synthetic Reagents
Mol File:
29471-17-8.mol
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4',4''(5'')-DI-TERT-BUTYLDIBENZO-18-CROWN-6 Chemical Properties

Melting point:
112-116 °C
Boiling point:
533.38°C (rough estimate)
Density 
1.0542 (rough estimate)
refractive index 
1.6000 (estimate)
BRN 
1667522
InChI
InChI=1S/C28H40O6/c1-27(2,3)21-7-9-23-25(19-21)33-17-13-30-14-18-34-26-20-22(28(4,5)6)8-10-24(26)32-16-12-29-11-15-31-23/h7-10,19-20H,11-18H2,1-6H3
InChIKey
CVQLBTRJDFZYMS-UHFFFAOYSA-N
SMILES
C12OCCOCCOC3=C(C=CC(C(C)(C)C)=C3)OCCOCCOC=1C=CC(C(C)(C)C)=C2
EPA Substance Registry System
Dibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecin, 2,13(or 2,14)-bis(1,1-dimethylethyl)-6,7,9,10,17,18,20,21-octahydro- (29471-17-8)
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Safety Information

Hazard Codes 
Xi
Risk Statements 
36/37/38-36/38-22
Safety Statements 
26-36-36/37
RIDADR 
2811
WGK Germany 
3
RTECS 
HP5386500
TSCA 
Yes
HazardClass 
6.1
PackingGroup 
III
HS Code 
29329990

MSDS

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4',4''(5'')-DI-TERT-BUTYLDIBENZO-18-CROWN-6 Usage And Synthesis

Description

4′,4″(5″)-Di-tert-butyldibenzo-18-crown-6 is a hydrophobic crown ether compound. This crown ether is potentially useful in studies of ion transport through non-polar regions and membranes, and has been described in the design of microsensor devices for ammonia determination based upon ammonia-mediated deprotonation of a pH indicator followed by sequestering of ammonium within the 4′,4″(5″)-Di-tert-butyldibenzo-18-crown-6 sphere.

Chemical Properties

Off-white powder

Uses

4'',4''''(5'''')-Di-tert-butyldibenzo-18-crown-6 is a hydrophobic crown ether compound..

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