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205383-17-1

205383-17-1 Structure

205383-17-1 Structure
IdentificationBack Directory
[Name]

4,4',4''-(benzene-1,3,5-triyltris(ethyne-2,1-diyl))tribenzoic acid
[CAS]

205383-17-1
[Synonyms]

H3BTE
4-(benzene-1
5-triyltris(ethyne-2
1-diyl))tribenzoic acid
1,3,5-Triscarboxyphenylethynylbenzene
1,3,5-Tris(4-carboxyphenylethynyl)benzene
1,3,5-Triscarboxyphenylethynylbenzene >=95%
1,3,5-Tris[2-(4-carboxyphenyl)-1-ethynyl]benzene
4,4′,4′′-(1,3,5-benzenetriyltri-2,1-ethynediyl)trisbenzoic acid
4,4',4''-(benzene-1,3,5-triyltris(ethyne-2,1-diyl))tribenzoic acid
Benzoic acid, 4,4',4''-(1,3,5-benzenetriyltri-2,1-ethynediyl)tris-
4-[2-[3,5-bis[2-(4-carboxyphenyl)ethynyl]phenyl]ethynyl]benzoic Acid
[Molecular Formula]

C33H18O6
[MDL Number]

MFCD17926334
[MOL File]

205383-17-1.mol
[Molecular Weight]

510.49
Chemical PropertiesBack Directory
[Melting point ]

352℃
[Boiling point ]

827.1±65.0 °C(Predicted)
[density ]

1.48±0.1 g/cm3(Predicted)
[storage temp. ]

Store at room temperature
[form ]

solid
[pka]

3.44±0.10(Predicted)
[Appearance]

Light yellow to brown Solid
[InChIKey]

NIJMZBWVSRWZFZ-UHFFFAOYSA-N
[SMILES]

C1(C#CC2=CC=C(C=C2)C(O)=O)=CC(C#CC2=CC=C(C=C2)C(O)=O)=CC(C#CC2=CC=C(C=C2)C(O)=O)=C1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

Expanded benzene tricarboxylate MOF linker used to synthesize MOFs with ultra high porosity; example MOF-180 and MOF-210. These MOFs show promising applications in gas adsorption; seperations; storage and more.
[General Description]

We are committed to bringing you Greener Alternative Products, which adhere to one or more of The 12 Principles of Greener Chemistry. This product has been enhanced for energy efficiency. Find details here.
Spectrum DetailBack Directory
[Spectrum Detail]

4,4',4''-(benzene-1,3,5-triyltris(ethyne-2,1-diyl))tribenzoic acid(205383-17-1)1HNMR
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