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15383-49-0

15383-49-0 Structure

15383-49-0 Structure
IdentificationBack Directory
[Name]

CYCLOHEXANE-1 2 4 5-TETRACARBOXYLIC ACI&
[CAS]

15383-49-0
[Synonyms]

1,2,4,5-cyclohexanetetracarboxylic acid
Cyclohexane-2,4,5-tetracarboxylic Acid
CYCLOHEXANE-1 2 4 5-TETRACARBOXYLIC ACI&
cyclohexane-1,2,4,5-tetracarboxylic acid, mixture of cis and trans
[Molecular Formula]

C10H12O8
[MDL Number]

MFCD00435556
[MOL File]

15383-49-0.mol
[Molecular Weight]

260.2
Chemical PropertiesBack Directory
[Melting point ]

>220 °C(lit.)
[Boiling point ]

549.1±50.0 °C(Predicted)
[density ]

1.673
[storage temp. ]

Sealed in dry,Room Temperature
[Water Solubility ]

Soluble in water
[form ]

powder to crystal
[pka]

2.98±0.44(Predicted)
[color ]

White to Almost white
[InChI]

InChI=1S/C10H12O8/c11-7(12)3-1-4(8(13)14)6(10(17)18)2-5(3)9(15)16/h3-6H,1-2H2,(H,11,12)(H,13,14)(H,15,16)(H,17,18)
[InChIKey]

ZPAKUZKMGJJMAA-UHFFFAOYSA-N
[SMILES]

C1(C(O)=O)CC(C(O)=O)C(C(O)=O)CC1C(O)=O
[CAS DataBase Reference]

15383-49-0
Hazard InformationBack Directory
[Chemical Properties]

White crystal
[Definition]

ChEBI: Cyclohexane-1,2,4,5-tetracarboxylic acid is an organooxygen compound. It is functionally related to a tetracarboxylic acid.
[Synthesis]

Pyromellitic acid

89-05-4

CYCLOHEXANE-1 2 4 5-TETRACARBOXYLIC ACI&

15383-49-0

The general procedure for the synthesis of cyclohexane-1,2,4,5-tetracarboxylic acid from homophthalic dianhydride was as follows: 34.3 g of commercially available homophthalic dianhydride (GC analytical purity: 98.2%) was added to a 500 mL autoclave, followed by the addition of 250 mL of deionized water and 2.5 g of 5 wt% Pd-C catalyst (as precious metal catalyst). Hydrogen was introduced into the autoclave, and the hydrogen pressure was controlled to be 2 MPa, the reaction temperature was 33 °C ± 1 °C, and the reaction time was 2 hours. After the reaction was completed, the system was cooled to room temperature (15°C~25°C) and the Pd-C catalyst was separated by filtration. The filter cake (Pd-C catalyst) was dried in air overnight and recycled for the next batch of catalytic hydrogenation reaction. The filtrate was distilled to remove the solvent, and a precipitate of hydrogenated homophthalic acid precipitated. The filtrate was filtered again and the filter cake was decolorized and purified with deionized water and activated carbon to give 38.8 g of white solid hydrogenated homophthalic tetracarboxylic acid in 99.1% yield and 99.46% GC purity.

[References]

[1] Patent: CN103992330, 2016, B. Location in patent: Page/Page column 5-7
[2] Patent: JP2017/202981, 2017, A. Location in patent: Paragraph 0105
[3] Patent: EP2316811, 2011, A1. Location in patent: Page/Page column 7-8
[4] Patent: JP6083270, 2017, B2. Location in patent: Paragraph 0048; 0056
[5] Patent: CN108069978, 2018, A
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

37/38-41-36/37/38
[Safety Statements ]

26-36/39
[WGK Germany ]

3
[HS Code ]

29172090
Spectrum DetailBack Directory
[Spectrum Detail]

CYCLOHEXANE-1 2 4 5-TETRACARBOXYLIC ACI&(15383-49-0)1HNMR
CYCLOHEXANE-1 2 4 5-TETRACARBOXYLIC ACI&(15383-49-0)IR
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