3,3',4,4'-Benzophenonetetracarboxylic Acid - CAS 2479-49-4
Catalog: |
BB018625 |
Product Name: |
3,3',4,4'-Benzophenonetetracarboxylic Acid |
CAS: |
2479-49-4 |
Synonyms: |
4-[(3,4-dicarboxyphenyl)-oxomethyl]phthalic acid; 4-(3,4-dicarboxybenzoyl)phthalic acid |
IUPAC Name: | 4-(3,4-dicarboxybenzoyl)phthalic acid |
Description: | 3,3',4,4'-Benzophenonetetracarboxylic Acid (CAS# 2479-49-4 ) is a useful research chemical. |
Molecular Weight: | 358.26 |
Molecular Formula: | C17H10O9 |
Canonical SMILES: | C1=CC(=C(C=C1C(=O)C2=CC(=C(C=C2)C(=O)O)C(=O)O)C(=O)O)C(=O)O |
InChI: | InChI=1S/C17H10O9/c18-13(7-1-3-9(14(19)20)11(5-7)16(23)24)8-2-4-10(15(21)22)12(6-8)17(25)26/h1-6H,(H,19,20)(H,21,22)(H,23,24)(H,25,26) |
InChI Key: | UITKHKNFVCYWNG-UHFFFAOYSA-N |
Boiling Point: | 734 °C at 760 mmHg |
Density: | 1.645 g/cm3 |
Appearance: | Dry powder |
MDL: | MFCD00020283 |
LogP: | 1.71040 |
GHS Hazard Statement: | H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin] |
Precautionary Statement: | P261, P272, P280, P302+P352, P321, P333+P313, P363, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
JP-2021080483-A | Complex | 20210304 |
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JP-6947323-B1 | Polyimide precursor composition and polyimide film | 20210219 |
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PMID | Publication Date | Title | Journal |
19565088 | 20090721 | Interplay of coordinative and supramolecular interactions in formation of a series of metal-organic complexes bearing diverse dimensionalities | Dalton transactions (Cambridge, England : 2003) |
21202495 | 20080514 | Poly[[diaqua-[μ(4)-4,4'-carbonyl-bis(benzene-1,2-dicarboxyl-ato)]bis-(dipyrido[3,2-a:2',3'-c]phenazine)dicadmium(II)] monohydrate] | Acta crystallographica. Section E, Structure reports online |
17447758 | 20070514 | Exceptional self-penetrating networks containing unprecedented quintuple-stranded molecular braid, 9-fold meso helices, and 17-fold interwoven helices | Inorganic chemistry |
16773662 | 20060825 | A bridge between pillared-layer and helical structures: a series of three-dimensional pillared coordination polymers with multiform helical chains | Chemistry (Weinheim an der Bergstrasse, Germany) |
15578848 | 20041213 | Hydrothermal syntheses, crystal structures, and properties of a novel class of 3,3',4,4'-benzophenone-tetracarboxylate (BPTC) polymers | Inorganic chemistry |
Complexity: | 574 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 358.03248189 |
Formal Charge: | 0 |
Heavy Atom Count: | 26 |
Hydrogen Bond Acceptor Count: | 9 |
Hydrogen Bond Donor Count: | 4 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 358.03248189 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 166 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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