[1,1':4',1″]Terphenyl- 3,3″,5,5″-tetracarboxylic acid - CAS 921619-89-8
Catalog: |
BB040449 |
Product Name: |
[1,1':4',1″]Terphenyl- 3,3″,5,5″-tetracarboxylic acid |
CAS: |
921619-89-8 |
Synonyms: |
5-[4-(3,5-dicarboxyphenyl)phenyl]benzene-1,3-dicarboxylic acid |
IUPAC Name: | 5-[4-(3,5-dicarboxyphenyl)phenyl]benzene-1,3-dicarboxylic acid |
Description: | [1,1':4',1″]Terphenyl- 3,3″,5,5″-tetracarboxylic acid (CAS# 921619-89-8 ) is a useful research chemical. |
Molecular Weight: | 406.34 |
Molecular Formula: | C22H14O8 |
Canonical SMILES: | C1=CC(=CC=C1C2=CC(=CC(=C2)C(=O)O)C(=O)O)C3=CC(=CC(=C3)C(=O)O)C(=O)O |
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) |
InChI Key: | HQCSLVYEWMDWIZ-UHFFFAOYSA-N |
LogP: | 3.81340 |
GHS Hazard Statement: | H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]; H410 (100%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard] |
Precautionary Statement: | P273, P391, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113354828-A | Preparation and application of novel stable metal organic framework material | 20210508 |
CN-112044459-A | Punicallyid porous nickel-based phosphide nano-structure material and preparation method and application thereof | 20200910 |
US-2021231628-A1 | Photoluminescence-based detection of acid gases via rare earth metal-organic frameworks | 20200107 |
CN-113130788-A | Composite material, thin film, and quantum dot light emitting diode | 20191231 |
WO-2021086483-A2 | Continuous synthesis of porous coordination polymers in supercritical carbon dioxide | 20190827 |
PMID | Publication Date | Title | Journal |
21160521 | 20110101 | Guest-induced growth of a surface-based supramolecular bilayer | Nature chemistry |
19159298 | 20090218 | High capacity hydrogen adsorption in Cu(II) tetracarboxylate framework materials: the role of pore size, ligand functionalization, and exposed metal sites | Journal of the American Chemical Society |
Complexity: | 579 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 406.0688674 |
Formal Charge: | 0 |
Heavy Atom Count: | 30 |
Hydrogen Bond Acceptor Count: | 8 |
Hydrogen Bond Donor Count: | 4 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 406.0688674 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 149 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.3 |
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