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calcium butanedioate hydrate

calcium butanedioate hydrate

Systemtic Name:calcium butanedioate hydrate
Openeye Name:calcium butanedioate hydrate
CAS Name:calcium butanedioate hydrate
IUPAC Name:calcium butanedioate hydrate
Traditional Name:calcium succinate hydrate
Formula: C4H6CaO5
MolecularWeight: 174.16544
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C4H6O4.Ca.H2O/c5-3(6)1-2-4(7)8;;/h1-2H2,(H,5,6)(H,7,8);;1H2/q;+2;/p-2


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