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calcium 2-propylpentanoate dihydrate

calcium 2-propylpentanoate dihydrate

Systemtic Name:calcium 2-propylpentanoate dihydrate
Openeye Name:calcium 2-propylpentanoate dihydrate
CAS Name:calcium 2-propylpentanoate dihydrate
IUPAC Name:calcium 2-propylpentanoate dihydrate
Traditional Name:calcium 2-propylvalerate dihydrate
Formula: C16H34CaO6
MolecularWeight: 362.51556
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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)[O-].CCCC(CCC)C(=O)[O-].O.O.[Ca+2]


Isomeric SMILES

CCCC(CCC)C(=O)[O-].CCCC(CCC)C(=O)[O-].O.O.[Ca+2]


InChI

InChI=1S/2C8H16O2.Ca.2H2O/c2*1-3-5-7(6-4-2)8(9)10;;;/h2*7H,3-6H2,1-2H3,(H,9,10);;2*1H2/q;;+2;;/p-2


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