CAS 3387-26-6 | Furan-3,4-dicarboxylic acid | CAS Number 3387-26-6

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3387-26-6 | Furan-3,4-dicarboxylic acid

CAS No: 3387-26-6 Catalog No: AG003IJ8 MDL No:MFCD00022465

Product Description

Catalog Number:

AG003IJ8

Chemical Name:

Furan-3,4-dicarboxylic acid

CAS Number:

3387-26-6

Molecular Formula:

C6H4O5

Molecular Weight:

156.0930

MDL Number:

MFCD00022465

IUPAC Name:

furan-3,4-dicarboxylic acid

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

SMILES:

OC(=O)c1cocc1C(=O)O

EC Number:

222-210-3

Properties

Complexity:

167

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

156.006g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

156.093g/mol

Monoisotopic Mass:

156.006g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

87.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

Literature

Title	Journal
Revalidation and rationale for high pKa values of unconjugated bilirubin.	BMC biochemistry 20070101
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501