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ChemicalBook--->CAS DataBase List--->53408-96-1

53408-96-1

53408-96-1 Structure

53408-96-1 Structure
IdentificationMore
[Name]

4-NITROBENZO-18-CROWN-6
[CAS]

53408-96-1
[Synonyms]

2,3-(4-NITROBENZO)-1,4,7,10,13,16-HEXAOXACYCLOOCTADEC-2-ENE
4'-NITROBENZO-18-CROWN-6
4-NITROBENZO-18-CROWN-6
4'-NITROBENZO-18-CROWN 6-ETHER
NITROBENZO-18-CROWN-6
4-Nitrobenzo-18-crown-6,99%
NITROBENZO-18-CROWN-6, 99+%
1,16-(4-Nitro-1,2-phenylene)-1,4,7,10,13,16-hexaoxahexadecane
18-Nitro-2,3,5,6,8,9,11,12,14,15-decahydro-1,4,7,10,13,16-benzohexaoxacyclooctadecin
[Molecular Formula]

C16H23NO8
[MDL Number]

MFCD00143207
[Molecular Weight]

357.36
[MOL File]

53408-96-1.mol
Chemical PropertiesBack Directory
[Appearance]

LIGHT YELLOW FLUFFY POWDER
[Melting point ]

82-86 °C
[Boiling point ]

453.11°C (rough estimate)
[density ]

1.163
[refractive index ]

1.5230 (estimate)
[CAS DataBase Reference]

53408-96-1(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi,C,F
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
R34:Causes burns.
R11:Highly Flammable.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S16:Keep away from sources of ignition-No smoking .
[WGK Germany ]

3
[F ]

3
[HS Code ]

29329990
Hazard InformationBack Directory
[Chemical Properties]

LIGHT YELLOW FLUFFY POWDER
[Purification Methods]

If impure and discoloured, then chromatograph it through Al2O3 and elute with *C6H6/hexane (1:1) containing 1% MeOH. The fractions are followed by TLC on Al2O3 (with Dragendorff's reagent for detection: RF 0.6 in the above solvent system). Recrystallise the residues from the required fractions from *C6H6/hexane to give yellowish leaflets. It complexes with Na or K ions with logKNa 3.95 and logKK 4.71. [Petranek & Ryba Collect Chem Czech Chem Commun 39 2033 1974.]
Spectrum DetailBack Directory
[Spectrum Detail]

4-NITROBENZO-18-CROWN-6(53408-96-1)MS
4-NITROBENZO-18-CROWN-6(53408-96-1)1HNMR
4-NITROBENZO-18-CROWN-6(53408-96-1)13CNMR
4-NITROBENZO-18-CROWN-6(53408-96-1)IR1
4-NITROBENZO-18-CROWN-6(53408-96-1)IR2
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Nitrobenzo-18-crown-6, 99+%(53408-96-1)
[Alfa Aesar]

4-Nitrobenzo-18-crown-6, 99%(53408-96-1)
[TCI AMERICA]

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