3,4-Furandicarboxylic Acid - CAS 3387-26-6

Catalog:	BB021875
Product Name:	3,4-Furandicarboxylic Acid
CAS:	3387-26-6
Synonyms:	furan-3,4-dicarboxylic acid; furan-3,4-dicarboxylic acid

Technical Data

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Computed Properties

IUPAC Name:	furan-3,4-dicarboxylic acid
Description:	Applications: 3,4-Furandicarboxylic acid is a useful research chemical.
Molecular Weight:	156.09
Molecular Formula:	C6H4O5
Canonical SMILES:	C1=C(C(=CO1)C(=O)O)C(=O)O
InChI:	InChI=1S/C6H4O5/c7-5(8)3-1-11-2-4(3)6(9)10/h1-2H,(H,7,8)(H,9,10)
InChI Key:	SYLAFCZSYRXBJF-UHFFFAOYSA-N
Boiling Point:	372.6±27.0 °C (Predicted)
Melting Point:	217-218 °C
Density:	1.604±0.06 g/cm³(Predicted)
LogP:	0.67600

Publication Number	Title	Priority Date
CN-113501945-A	High-strength high-toughness high-barrier random copolyester and preparation method thereof	20210728
CN-113117745-A	Preparation method and application of metal-free catalyst	20210413
CN-112592467-A	High glass transition temperature low melting point polyester, polyester product, and preparation method and application thereof	20210226
CN-113150536-A	Composition containing polybutyrolactam or derivatives thereof, and preparation method and application thereof	20201228
CN-112210070-A	Novel self-repairing epoxy resin curing agent and preparation method and application thereof	20201013

PMID	Publication Date	Title	Journal
17475001	20070502	Revalidation and rationale for high pKa values of unconjugated bilirubin	BMC biochemistry

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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
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0