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Substance Name: Calcium 3-hydroxy-4-oxopyran-2,6-dicarboxylate
RN: 831-53-8
InChIKey: WJAFWYSUARCPKN-UHFFFAOYSA-L

Molecular Formula

  • C7-H4-O7.Ca

Molecular Weight

  • 238.1638
 
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Names and Synonyms

Synonym

  • EINECS 212-604-3

Systematic Name

  • Calcium 3-hydroxy-4-oxopyran-2,6-dicarboxylate

Registry Numbers

CAS Registry Number

  • 831-53-8

System Generated Number

  • 0000831538

Molecular Formulas

Molecular Formula

  • C7-H4-O7.Ca

Molecular Formula Fragments

  • C7-H4-O7
  • Ca
  • COMPONENT

Structure Descriptors

InChI

1S/C7H4O7.Ca/c8-2-1-3(6(10)11)14-5(4(2)9)7(12)13;/h1,9H,(H,10,11)(H,12,13);/q;+2/p-2

InChIKey

WJAFWYSUARCPKN-UHFFFAOYSA-L

Smiles

[Ca+2].OC1=C(OC(=CC1=O)C(=O)[O-])C(=O)[O-]