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The molecular formula is C12H22CaO6.
It was created on 2007-12-05 and last modified on 2023-12-30.
The IUPAC name is calcium; 2-hydroxy-3-methylpentanoate.
The InChIKey is LISYOSJUJNUSPU-UHFFFAOYSA-L.
The Canonical SMILES is CCC(C)C(C(=O)[O-])O.CCC(C)C(C(=O)[O-])O.[Ca+2].
The CAS number is 93778-32-6.
There are 2 hydrogen bond donor counts.
There are 6 hydrogen bond acceptor counts.
The topological polar surface area is 121 Ų.
Yes, the compound is canonicalized.
93778-26-8
93778-28-0
93778-31-5
93778-36-0
93778-37-1
93778-38-2
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