2,5-Furandicarboxylic Acid - CAS 3238-40-2
Catalog: |
BB021271 |
Product Name: |
2,5-Furandicarboxylic Acid |
CAS: |
3238-40-2 |
Synonyms: |
furan-2,5-dicarboxylic acid; furan-2,5-dicarboxylic acid |
IUPAC Name: | furan-2,5-dicarboxylic acid |
Description: | 2,5-Furandicarboxylic Acid (CAS# 3238-40-2) is a derivative of Furan (F863650), which can be produced from biomass-derived sugars using catalytic processes. It is one of the most important chemical building blocks from biomass. |
Molecular Weight: | 156.09 |
Molecular Formula: | C6H4O5 |
Canonical SMILES: | C1=C(OC(=C1)C(=O)O)C(=O)O |
InChI: | InChI=1S/C6H4O5/c7-5(8)3-1-2-4(11-3)6(9)10/h1-2H,(H,7,8)(H,9,10) |
InChI Key: | CHTHALBTIRVDBM-UHFFFAOYSA-N |
Boiling Point: | 240.29 ℃ (rough estimate) |
Melting Point: | >310 ℃ (dec.) |
Flash Point: | 168 °F |
Purity: | 97 % |
Density: | 1.7400 g/cm3 |
Solubility: | 1 mg/mL at 18 °C |
Appearance: | White to almost white powder to crystal |
MDL: | MFCD00016582 |
LogP: | 0.67600 |
Refractive Index: | 1.6400 (estimate) |
GHS Hazard Statement: | H315 (26.59%): 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-113429571-A | Method for preparing high-temperature-resistant nylon by using amidation reaction of polyester | 20210819 |
CN-113461645-A | Method for synthesizing 2, 5-furandicarboxylic acid from furancarboxylic acid and carbon dioxide | 20210806 |
CN-113512016-A | Method for preparing 5-hydroxymethylfurfural by using lithium bromide molten salt hydrate-acetone system to catalyze carbohydrate through one-pot method | 20210802 |
CN-113501945-A | High-strength high-toughness high-barrier random copolyester and preparation method thereof | 20210728 |
CN-113429569-A | Preparation method of high molecular weight furan polyamide | 20210723 |
PMID | Publication Date | Title | Journal |
24802551 | 20140616 | Enzyme-catalyzed oxidation of 5-hydroxymethylfurfural to furan-2,5-dicarboxylic acid | Angewandte Chemie (International ed. in English) |
24271187 | 20140201 | Discovery and characterization of a 5-hydroxymethylfurfural oxidase from Methylovorus sp. strain MP688 | Applied and environmental microbiology |
22941583 | 20121001 | Development and validation of an HPLC method to determine metabolites of 5-hydroxymethylfurfural (5-HMF) | Journal of separation science |
22830993 | 20120910 | High molecular weight poly(butylene succinate-co-butylene furandicarboxylate) copolyesters: from catalyzed polycondensation reaction to thermomechanical properties | Biomacromolecules |
22969443 | 20120901 | catena-Poly[[(1,3-dimethyl-imidazolin-2-one-κN)(1,10-phenanthroline-κ(2)N,N')copper(II)]-μ-furan-2,5-dicarboxyl-ato-κ(2)O(2):O(5)] | Acta crystallographica. Section E, Structure reports online |
Complexity: | 167 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 156.00587322 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 156.00587322 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 87.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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