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528543-96-6

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528543-96-6 Structure

528543-96-6 Structure
IdentificationBack Directory
[Name]

1,3,5-tri(1H-iMidazol-1-yl)benzene
[CAS]

528543-96-6
[Synonyms]

JACS-528543-96-6
1,3,5-tri(1H-iMidazol-1-yl)benzene
1,1',1''-Benzene-1,3,5-triyltri(1H-imidazole)
1H-Imidazole, 1,1',1''-(1,3,5-benzenetriyl)tris-
[Molecular Formula]

C15H12N6
[MDL Number]

MFCD23103303
[MOL File]

528543-96-6.mol
[Molecular Weight]

276.296
Chemical PropertiesBack Directory
[Melting point ]

303 °C(dec.)
[Boiling point ]

600.9±50.0 °C(Predicted)
[density ]

1.33±0.1 g/cm3(Predicted)
[storage temp. ]

Store at room temperature
[form ]

powder to crystal
[pka]

5.71±0.10(Predicted)
[color ]

White to Orange to Green
[InChI]

InChI=1S/C15H12N6/c1-4-19(10-16-1)13-7-14(20-5-2-17-11-20)9-15(8-13)21-6-3-18-12-21/h1-12H
[InChIKey]

QAPWMCQWTGBLSM-UHFFFAOYSA-N
[SMILES]

C1(N2C=NC=C2)=CC(N2C=NC=C2)=CC(N2C=NC=C2)=C1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P280-P301+P312-P302+P352-P305+P351+P338
Hazard InformationBack Directory
[Uses]

1,3,5-Tri(1H-iMidazol-1-yl)benzene is used as a ligand in the synthesis of MOF materials.
Spectrum DetailBack Directory
[Spectrum Detail]

1,3,5-tri(1H-iMidazol-1-yl)benzene(528543-96-6)1HNMR
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