2,5-Dihydroxyterephthalic Acid - CAS 610-92-4
Catalog: |
BB030941 |
Product Name: |
2,5-Dihydroxyterephthalic Acid |
CAS: |
610-92-4 |
Synonyms: |
2,5-dihydroxyterephthalic acid; 2,5-dihydroxyterephthalic acid |
IUPAC Name: | 2,5-dihydroxyterephthalic acid |
Description: | 2,5-dihydroxyterephthalic acid (DHTA)is prepared by bromine/sulphuric acid mediated aromatization of diethyl succinoylsucinate, followed by hydrolysis. |
Molecular Weight: | 198.13 |
Molecular Formula: | C8H6O6 |
Canonical SMILES: | C1=C(C(=CC(=C1O)C(=O)O)O)C(=O)O |
InChI: | InChI=1S/C8H6O6/c9-5-1-3(7(11)12)6(10)2-4(5)8(13)14/h1-2,9-10H,(H,11,12)(H,13,14) |
InChI Key: | OYFRNYNHAZOYNF-UHFFFAOYSA-N |
Boiling Point: | 498.9 °C at 760 mmHg |
Melting Point: | >300 °C (lit.) |
Purity: | > 98.0 % (T) (HPLC) |
Density: | 1.779 g/cm3 |
Appearance: | Light yellow to yellow to green powder to crystal |
Storage: | Store under inert gas |
MDL: | MFCD00132933 |
LogP: | 0.49420 |
GHS Hazard Statement: | H315 (100%): 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 |
CN-113430839-A | Method for preparing compact aramid fiber coring soft bag by using high-performance benzoxazole polymer | 20210713 |
CN-113509933-A | Copper-cobalt composite carbon material derived based on metal-organic framework material, method thereof and wastewater treatment method | 20210709 |
CN-113461959-A | Method for preparing metal organic framework material by high-pressure homogenization | 20210701 |
CN-113413919-A | Hedgehog shaped catalytic material with atom catalytic center and its use in preparing antibacterial medicine | 20210621 |
CN-113422059-A | High-voltage carbon fluoride composite cathode material and preparation method thereof | 20210617 |
PMID | Publication Date | Title | Journal |
22903310 | 20121014 | Carbon dioxide adsorption by physisorption and chemisorption interactions in piperazine-grafted Ni2(dobdc) (dobdc = 1,4-dioxido-2,5-benzenedicarboxylate) | Dalton transactions (Cambridge, England : 2003) |
22892796 | 20121007 | Diversity of lanthanide(III)-2,5-dihydroxy-1,4-benzenedicarboxylate extended frameworks: syntheses, structures, and magnetic properties | Dalton transactions (Cambridge, England : 2003) |
22988809 | 20121001 | Luminescent microporous metal-organic framework with functional lewis basic sites on the pore surface: specific sensing and removal of metal ions | Inorganic chemistry |
22908934 | 20120905 | CO2 dynamics in a metal-organic framework with open metal sites | Journal of the American Chemical Society |
22371265 | 20120414 | Hydrogen adsorption in the metal-organic frameworks Fe2(dobdc) and Fe2(O2)(dobdc) | Dalton transactions (Cambridge, England : 2003) |
Complexity: | 224 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 198.01643791 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 4 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 198.01643791 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 115 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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