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calcium butanedioic acid dichloride dodecahydrate

calcium butanedioic acid dichloride dodecahydrate

Systemtic Name:calcium butanedioic acid dichloride dodecahydrate
Openeye Name:calcium succinic acid dichloride dodecahydrate
CAS Name:calcium butanedioic acid dichloride dodecahydrate
IUPAC Name:calcium butanedioic acid dichloride dodecahydrate
Traditional Name:calcium succinic acid dichloride dodecahydrate
Formula: C4H30CaCl2O16
MolecularWeight: 445.2554
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C4H6O4.Ca.2ClH.12H2O/c5-3(6)1-2-4(7)8;;;;;;;;;;;;;;;/h1-2H2,(H,5,6)(H,7,8);;2*1H;12*1H2/q;+2;;;;;;;;;;;;;;/p-2


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