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Substance Name: Pentaric acid, calcium salt (1:?)
RN: 68568-63-8
InChIKey: AYECNEQRBSXESR-UHFFFAOYSA-L

Molecular Formula

  • C5-H8-O7.x-Ca

Molecular Weight

  • 218.173
 
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Names and Synonyms

Synonym

  • EINECS 271-499-2

Systematic Names

  • 1-Hydroxypropane-1,2,3-tricarboxylic acid, calcium salt
  • Pentaric acid, calcium salt
  • Pentaric acid, calcium salt (1:?)

Registry Numbers

CAS Registry Number

  • 68568-63-8

System Generated Number

  • 0068568638

Molecular Formulas

Molecular Formula

  • C5-H8-O7.x-Ca

Molecular Formula Fragments

  • C5-H8-O7
  • Ca
  • COMPONENT

Structure Descriptors

InChI

1S/C5H8O7.Ca/c6-1(2(7)4(9)10)3(8)5(11)12;/h1-3,6-8H,(H,9,10)(H,11,12);/q;+2/p-2

InChIKey

AYECNEQRBSXESR-UHFFFAOYSA-L

Smiles

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