52479-85-3 Purity
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Specification
The molecular formula of Dikegulac sodium is C12H17NaO7.
Dikegulac sodium was created on 2008-02-05 and modified on 2023-12-30.
The IUPAC Name of Dikegulac sodium is sodium;(1R,2S,6R,8S)-4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[6.4.0.0 2,6 ]dodecane-6-carboxylate.
The molecular weight of Dikegulac sodium is 296.25 g/mol.
The Canonical SMILES of Dikegulac sodium is CC1(OCC2C(O1)C3C(O2)(OC(O3)(C)C)C(=O)[O-]).[Na+].
The UNII of Dikegulac sodium is 3M4815901H.
Dikegulac sodium has 7 hydrogen bond acceptors.
The topological polar surface area of Dikegulac sodium is 86.3 Ų.
Dikegulac sodium contains 20 heavy atoms.
Dikegulac sodium has 4 defined atom stereocenters.