1,2,4-Benzenetricarboxylic acid - CAS 528-44-9
Catalog: |
BB027964 |
Product Name: |
1,2,4-Benzenetricarboxylic acid |
CAS: |
528-44-9 |
Synonyms: |
benzene-1,2,4-tricarboxylic acid |
IUPAC Name: | benzene-1,2,4-tricarboxylic acid |
Description: | 1,2,4-Benzenetricarboxylic acid (CAS# 528-44-9) is a reagent used in the preparation of coordination polymers containing various luminescent properties. |
Molecular Weight: | 210.14 |
Molecular Formula: | C9H6O6 |
Canonical SMILES: | C1=CC(=C(C=C1C(=O)O)C(=O)O)C(=O)O |
InChI: | InChI=1S/C9H6O6/c10-7(11)4-1-2-5(8(12)13)6(3-4)9(14)15/h1-3H,(H,10,11)(H,12,13)(H,14,15) |
InChI Key: | ARCGXLSVLAOJQL-UHFFFAOYSA-N |
Boiling Point: | 505.5 °C at 760 mmHg |
Melting Point: | 229-231 °C |
Purity: | 95 % |
Density: | 1.654 g/cm3 |
Appearance: | White crystalline powder |
MDL: | MFCD00002470 |
LogP: | 0.78120 |
Vapor Pressure: | 0.00000003 [mmHg] |
GHS Hazard Statement: | H315 (99.26%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-10934384-B1 | Polyurethane elastomer compositions, and processes thereof | 20200909 |
US-10934385-B1 | Polyurethane elastomers, bio-additive foam compositions | 20200909 |
US-10757988-B1 | Personal protective equipment with functionalized nanotube compositions to control pathogens such as SARS CoV-2 (coronavirus) | 20200407 |
US-10919020-B1 | Air filters with functionalized nanotube compositions to control pathogens such as SARS CoV-2 (coronavirus) | 20200407 |
US-10767004-B1 | Tricyclodecane dimethanol composition and uses thereof | 20200113 |
PMID | Publication Date | Title | Journal |
26732893 | 20160118 | Evaluation of 5-methylcytosine and 5-hydroxymethylcytosine as potential biomarkers for characterisation of chemical allergens | Toxicology |
22864596 | 20120828 | Assembly and properties of transition-metal coordination polymers based on semi-rigid bis-pyridyl-bis-amide ligand: effect of polycarboxylates on the dimensionality | Dalton transactions (Cambridge, England : 2003) |
22047800 | 20111201 | Benzenepolycarboxylic acids with potential anti-hemorrhagic properties and structure-activity relationships | Bioorganic & medicinal chemistry |
22065634 | 20111001 | catena-Poly[[diaquaterbium(III)]-tetrakis(μ(2)-pyridine-4-carboxylato-κO:O')-[diaquaterbium(III)]-bis(μ(2)-pyridine-4-carboxylato-κO:O')] | Acta crystallographica. Section E, Structure reports online |
21764421 | 20110901 | Beyond phthalates: gas phase concentrations and modeled gas/particle distribution of modern plasticizers | The Science of the total environment |
Complexity: | 297 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 210.01643791 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 210.01643791 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 112 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.3 |
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