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921619-89-8

921619-89-8 Structure

921619-89-8 Structure
IdentificationBack Directory
[Name]

[1,1′:4′,1″]Terphenyl- 3,3″,5,5″-tetracarboxylic acid
[CAS]

921619-89-8
[Synonyms]

H4TPTC
1,4-di(3',5'-dicarboxylphenyl)benzene
1,3-di(3',5'-dicarboxylphenyl)benzene
p-Terphenyl-3,3'',5,5''-tetracarboxylic acid
4′,1″]Terphenyl- 3,3″,5,5″-tetracarboxylic acid
[1,1′:4′,1″]Terphenyl- 3,3″,5,5″-tetracarboxylic acid
[1,1':4',1"]Terphenyl- 3,3",5,5"-tetracarboxylic acid cont
5-[4-(3,5-dicarboxyphenyl)phenyl]benzene-1,3-dicarboxylic acid
[1,1′:4′,1″]Terphenyl- 3,3″,5,5″-tetracarboxylic acid ISO 9001:2015 REACH
[1,1':4',1"]Terphenyl- 3,3",5,5"-tetracarboxylic acid contains up to 2 equivalents of DMF
[Molecular Formula]

C22H14O8
[MDL Number]

MFCD16875674
[MOL File]

921619-89-8.mol
[Molecular Weight]

406.342
Chemical PropertiesBack Directory
[Melting point ]

>370°C
[Boiling point ]

836.7±65.0 °C(Predicted)
[density ]

1.504±0.06 g/cm3(Predicted)
[storage temp. ]

Store at room temperature
[form ]

solid
[pka]

3.11±0.10(Predicted)
[Appearance]

White to off-white Solid
[InChI]

InChI=1S/C22H14O8/c23-19(24)15-5-13(6-16(9-15)20(25)26)11-1-2-12(4-3-11)14-7-17(21(27)28)10-18(8-14)22(29)30/h1-10H,(H,23,24)(H,25,26)(H,27,28)(H,29,30)
[InChIKey]

HQCSLVYEWMDWIZ-UHFFFAOYSA-N
[SMILES]

C1(C2=CC=C(C3=CC(C(O)=O)=CC(C(O)=O)=C3)C=C2)=CC(C(O)=O)=CC(C(O)=O)=C1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)Health Hazard (GHS08)
GHS07,GHS08
[Signal word ]

Danger
[Hazard statements ]

H319-H360D-H413
[Precautionary statements ]

P202-P264-P273-P280-P305+P351+P338-P308+P313
[Hazard Codes ]

T,N
[Risk Statements ]

61-20/21-36-50/53
[Safety Statements ]

53-26-36/37-45-61
[RIDADR ]

UN 3077 9 / PGIII
[WGK Germany ]

3
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Aquatic Chronic 4
Eye Irrit. 2
Repr. 1B
Hazard InformationBack Directory
[Uses]

[1,1′:4′,1″]Terphenyl- 3,3″,5,5″-tetracarboxylic acid (H4TPTC) is used as a linker for the synthesis of NOTT-101 metal organic framework (MOFs).
[Definition]

ChEBI: H4TPTC is a para-terphenyl.
[General Description]

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Spectrum DetailBack Directory
[Spectrum Detail]

[1,1′:4′,1″]Terphenyl- 3,3″,5,5″-tetracarboxylic acid(921619-89-8)1HNMR
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