3,4-Furandicarboxylic Acid
| Catalog Number | Size | Price | Stock | Quantity |
|---|---|---|---|---|
| BPM-313956 | 1 g | $299 | In stock |
Product Information
Molecular Formula
C6H4O5
Molecular Weight
156.09
Description
3,4-Furandicarboxylic acid is a useful research chemical.
Synonyms
Furan-3,4-dicarbonsure
IUPAC Name
furan-3,4-dicarboxylic acid
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
Purity
≥95%
Density
1.604±0.06 g/cm3(Predicted)
Appearance
White to Off-white Solid
LogP
0.67600
Computed Properties
XLogP3
0
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
2
Exact Mass
156.00587322 g/mol
Monoisotopic Mass
156.00587322 g/mol
Topological Polar Surface Area
87.7Ų
Heavy Atom Count
11
Formal Charge
0
Complexity
167
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
