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68941-06-0

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68941-06-0 Structure

68941-06-0 Structure
IdentificationBack Directory
[Name]

4'-Aminobenzo-18-crown-6
[CAS]

68941-06-0
[Synonyms]

4'-AMINOBENZO-18-CROWN-6
(BENZO-18-CROWN-6)-4'-YLAMINE
4-AMINOBENZO-18-CROWN-6 PURUM,97%
4'-AMinobenzo-18-crown-6 technical
4-AMINOBENZO-18-CROWN-6 SESQUIHYDRATE HYDROCHLORIDE
2,3,5,6,8,9,11,12,14,15-Decahydro-1,4,7,10,13,16-benzohexaox
2,3,5,6,8,9,11,12,14,15-DECAHYDRO-1,4,7,10,13,16-BENZOHEXAOXACYCLOOCTADECIN-18-AMINE
1,4,7,10,13,16-Benzohexaoxacyclooctadecin-18-amine, 2,3,5,6,8,9,11,12,14,15-decahydro-
2,3,5,6,8,9,11,12,14,15-decahydrobenzo[b][1,4,7,10,13,16]hexaoxacyclooctadecin-18-aMine
2,3,5,6,8,9,11,12,14,15-DECAHYDRO-1,4,7,10,13,16-BENZOHEXAOXXACYCLO-OCTADECIN-18-AMINE HYDROCHLORIDE
[Molecular Formula]

C16H25NO6
[MDL Number]

MFCD00210009
[MOL File]

68941-06-0.mol
[Molecular Weight]

327.37
Chemical PropertiesBack Directory
[Melting point ]

53-56 °C
[Boiling point ]

511.9±50.0 °C(Predicted)
[density ]

1.099±0.06 g/cm3(Predicted)
[storage temp. ]

0-6°C
[pka]

4.62±0.20(Predicted)
[Appearance]

Light brown to brown Solid
[BRN ]

5296463
[InChI]

InChI=1S/C16H25NO6/c17-14-1-2-15-16(13-14)23-12-10-21-8-6-19-4-3-18-5-7-20-9-11-22-15/h1-2,13H,3-12,17H2
[InChIKey]

PZXYILUXRGTFGD-UHFFFAOYSA-N
[SMILES]

O1C2=CC=C(N)C=C2OCCOCCOCCOCCOCC1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-36
[WGK Germany ]

3
[F ]

8-10
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Description]

4′-Aminophenyl-18-crown-6 is a cyclic compound. It is widely used as an ion carrier. It coordinates to metal ions more easily than other ligands because its planar oxygen atoms provide a strong negative potential barrier. 4'-aminobenzo-18-Crown-6 (AB18C6) could be used to design and fabricate a novel magnetic absorbent for absorption and determination of lead metal ion (Pb2+) based on a self-assembly approach via the dehydration condensation[1].
[References]

[1] yan Jing-Kang et al. “4′-Aminobenzo-18-crown-6 functionalized magnetic nanoparticles as a solid-phase extraction adsorbent for the determination of Pb2+?.” Analytical Methods 13 (2019): 1735–1742.
Questions And AnswerBack Directory
[Application]

4'-Aminobenzo-18-crown ether-6 is a crown ether compound used as a catalyst in organic synthesis reactions.
Spectrum DetailBack Directory
[Spectrum Detail]

4'-Aminobenzo-18-crown-6(68941-06-0)1HNMR
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