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Structure

Calcium 2-hydroxy-3-methylvalerate

CAS
93778-32-6
Catalog Number
ACM93778326
Category
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What is the molecular formula of Calcium 2-hydroxy-3-methylvalerate?

The molecular formula is C12H22CaO6.

When was Calcium 2-hydroxy-3-methylvalerate created and last modified?

It was created on 2007-12-05 and last modified on 2023-12-30.

What is the IUPAC name of Calcium 2-hydroxy-3-methylvalerate?

The IUPAC name is calcium; 2-hydroxy-3-methylpentanoate.

What is the InChIKey of Calcium 2-hydroxy-3-methylvalerate?

The InChIKey is LISYOSJUJNUSPU-UHFFFAOYSA-L.

What is the Canonical SMILES of Calcium 2-hydroxy-3-methylvalerate?

The Canonical SMILES is CCC(C)C(C(=O)[O-])O.CCC(C)C(C(=O)[O-])O.[Ca+2].

What is the CAS number of Calcium 2-hydroxy-3-methylvalerate?

The CAS number is 93778-32-6.

How many hydrogen bond donor counts are in Calcium 2-hydroxy-3-methylvalerate?

There are 2 hydrogen bond donor counts.

How many hydrogen bond acceptor counts are in Calcium 2-hydroxy-3-methylvalerate?

There are 6 hydrogen bond acceptor counts.

What is the topological polar surface area of Calcium 2-hydroxy-3-methylvalerate?

The topological polar surface area is 121 Ų.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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