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Benzenepentacarboxylic acid

CAS No.:
1585-40-6
Catalog Number:
AG001Q8H
Molecular Formula:
C11H6O10
Molecular Weight:
298.1593
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
99%
1 week
United States
$140
- +
500mg
99%
1 week
United States
$190
- +
25g
>98.0%(T)(HPLC)
1 week
United States
$1145
- +
Product Description
Catalog Number:
AG001Q8H
Chemical Name:
Benzenepentacarboxylic acid
CAS Number:
1585-40-6
Molecular Formula:
C11H6O10
Molecular Weight:
298.1593
MDL Number:
MFCD00020281
IUPAC Name:
benzene-1,2,3,4,5-pentacarboxylic acid
InChI:
InChI=1S/C11H6O10/c12-7(13)2-1-3(8(14)15)5(10(18)19)6(11(20)21)4(2)9(16)17/h1H,(H,12,13)(H,14,15)(H,16,17)(H,18,19)(H,20,21)
InChI Key:
QNSOHXTZPUMONC-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(C(=O)O)c(c(c1C(=O)O)C(=O)O)C(=O)O
EC Number:
216-441-9
UNII:
1XI0AN8BWS
NSC Number:
12096
Properties
Complexity:
471  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.996g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
5  
Isotope Atom Count:
0
Molecular Weight:
298.159g/mol
Monoisotopic Mass:
297.996g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
187A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Literature
Title Journal
Benzenepolycarboxylic acids with potential anti-hemorrhagic properties and structure-activity relationships. Bioorganic & medicinal chemistry 20111201
Poly[1,4-bis-(4-pyridylmeth-yl)piperazine-diium [[tetra-aqua-cobaltate(II)]-μ-pyromellitato-κO:O] dihydrate]. Acta crystallographica. Section E, Structure reports online 20091201
Synthesis, structures, and magnetic properties of metal-coordination polymers with benzenepentacarboxylate linkers. Inorganic chemistry 20080204
Hydrothermal synthesis, structures, and photoluminescent properties of benzenepentacarboxylate bridged networks incorporating zinc(II)-hydroxide clusters or zinc(II)-carboxylate layers. Inorganic chemistry 20080107
Properties