chempirical

Aluminum clofibrate

C20H21AlCl2O7CAS 24818-79-9471.26 g/mol

Open in Covalent MOL file
OClOO−OClOO−Al3+HO−
Aryl halideCarboxylic acidEther

Properties

Molecular formula
C20H21AlCl2O7
Molar mass
471.26 g/mol
Exact mass
470.0480 Da
logP
1.94Crippen estimate
Polar surface area
128.7 Ų
H-bond donors / acceptors
0 / 7
Rotatable bonds
6

Identifiers

CAS number
24818-79-9
SMILES
CC(C)(Oc1ccc(Cl)cc1)C(=O)[O-].CC(C)(Oc1ccc(Cl)cc1)C(=O)[O-].[Al+3].[OH-]
InChIKey
USWVMPGQVYZHCA-UHFFFAOYSA-K
InChI
InChI=1S/2C10H11ClO3.Al.H2O/c2*1-10(2,9(12)13)14-8-5-3-7(11)4-6-8;;/h2*3-6H,1-2H3,(H,12,13);;1H2/q;;+3;/p-3

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Type any one amount. The others follow from the molar mass.

Names and synonyms

10 names
  • Aluminum, bis[2-(4-chlorophenoxy-κO)-2-methylpropanoato-κO]hydroxy-
  • Aluminum, bis[2-(p-chlorophenoxy)-2-methylpropionato]hydroxy-
  • Aluminum, bis[2-(4-chlorophenoxy)-2-methylpropanoato-O1,O2]hydroxy-
  • Propanoic acid, 2-(4-chlorophenoxy)-2-methyl-, aluminum complex
  • Bis[2-(4-chlorophenoxy-κO)-2-methylpropanoato-κO]hydroxyaluminum
  • Alufibrate
  • Alfibrate
  • Atherolip
  • Aluminium clofibrate
  • Atherolipin

Work with Aluminum clofibrate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Clofibric acid882-09-753 % similar Clofibrate637-07-049 % similar Fenofibric acid42017-89-047 % similar Fenofibrate49562-28-943 % similar 1-Chloro-4-(trifluoromethoxy)benzene461-81-439 % similar Bezafibrate41859-67-039 % similar 2-Oxiranecarboxylic acid, 2-[6-(4-chlorophenoxy)hexyl]-, sodium salt (1:1), (2R)-828934-41-439 % similar Etofibrate31637-97-538 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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