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Home Carboxys 1,2,4,5-Cyclohexanetetracarboxylic acid

1,2,4,5-Cyclohexanetetracarboxylic acid

CAS No.:
15383-49-0
Catalog Number:
AG003P4G
Molecular Formula:
C10H12O8
Molecular Weight:
260.1975
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$12
- +
5g
>98.0%(GC)(T)
1 week
United States
$210
- +
25g
>98.0%(GC)(T)
1 week
United States
$627
- +
Product Description
Catalog Number:
AG003P4G
Chemical Name:
1,2,4,5-Cyclohexanetetracarboxylic acid
CAS Number:
15383-49-0
Molecular Formula:
C10H12O8
Molecular Weight:
260.1975
MDL Number:
MFCD00435556
IUPAC Name:
cyclohexane-1,2,4,5-tetracarboxylic acid
InChI:
InChI=1S/C10H12O8/c11-7(12)3-1-4(8(13)14)6(10(17)18)2-5(3)9(15)16/h3-6H,1-2H2,(H,11,12)(H,13,14)(H,15,16)(H,17,18)
InChI Key:
ZPAKUZKMGJJMAA-UHFFFAOYSA-N
SMILES:
OC(=O)C1CC(C(=O)O)C(CC1C(=O)O)C(=O)O
Properties
Complexity:
327  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.053g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
260.198g/mol
Monoisotopic Mass:
260.053g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
149A^2
Undefined Atom Stereocenter Count:
4  
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.2  
Literature
Title Journal
Two new 1,2,4,5-cyclohexanetetracarboxylate-bridged frameworks with metal hydroxide subunits. Synthesis, structures, magnetism and adsorption. Dalton transactions (Cambridge, England : 2003) 20110414
4,4'-Bipyridine-cyclo-hexane-1,2,4,5-tetra-carb-oxy-lic acid (1/1). Acta crystallographica. Section E, Structure reports online 20101101
Conformation preference of a flexible cyclohexanetetracarboxylate ligand in three new metal-organic frameworks: structures, magnetic and luminescent properties. Inorganic chemistry 20090803
Properties