Calcium dihydrogen citrate

CAS Registry Number®

109459-70-3
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CAS Name

Calcium dihydrogen citrate

Molecular Formula

C6H8O7.1/2Ca

Cite this Page

Calcium dihydrogen citrate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=109459-70-3 (retrieved 2024-03-19) (CAS RN: 109459-70-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C6H8O7.Ca/c7-3(8)1-6(13,5(11)12)2-4(9)10;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);

InChIKey

InChIKey=QXDHJHQRJCJRAU-UHFFFAOYSA-N

SMILES

C(CC(O)=O)(CC(O)=O)(C(O)=O)O.[Ca]

Canonical SMILES

[Ca].O=C(O)CC(O)(C(=O)O)CC(=O)O

Other Names for this Substance

  • 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, calcium salt (2:1)
  • Calcium dihydrogen citrate

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