chempirical

Ferric stearate

C54H105FeO6CAS 555-36-2906.27 g/mol

Open in Covalent MOL file
O−OO−OO−OFe3+
Carboxylic acid

Properties

Molecular formula
C54H105FeO6
Molar mass
906.27 g/mol
Exact mass
905.7261 Da
logP
6.33Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
16

Identifiers

CAS number
555-36-2
SMILES
CCCCCCCCCCCCCCCCCC([O-])=O.CCCCCCCCCCCCCCCCCC([O-])=O.CCCCCCCCCCCCCCCCCC([O-])=O.[Fe+3]
InChIKey
PHACENXRVBYYEW-UHFFFAOYSA-N
InChI
InChI=1S/C18H36O2.Fe/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;/h2-17H2,1H3,(H,19,20);

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

Names and synonyms

6 names
  • Octadecanoic acid, iron(3+) salt (3:1)
  • Stearic acid, iron(3+) salt
  • Octadecanoic acid, iron(3+) salt
  • Iron(III) stearate
  • Ferric tristearate
  • Iron tristearate

Work with Ferric stearate

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

Sodium caprate1002-62-678 % similar Manganese stearate1002-88-678 % similar Potassium laurate10124-65-978 % similar Lead stearate1072-35-178 % similar Calcium stearate1592-23-078 % similar Sodium octanoate1984-06-178 % similar Cadmium stearate2223-93-078 % similar Potassium palmitate2624-31-978 % similar

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

Elsewhere

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