Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Octacalcium phosphate
RN: 13767-12-9
InChIKey: YIGWVOWKHUSYER-UHFFFAOYSA-F

Molecular Formula

  • Ca.3/4-H3-O4-P

Molecular Weight

  • 446.23
 
* denotes mobile formatted website

Links to Resources


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Octacalcium phosphate

Synonyms

  • Octacalcium dihydrogen phosphate
  • Octacalcium phosphate

Systematic Name

  • Phosphoric acid, calcium salt (3:4)

Registry Numbers

CAS Registry Number

  • 13767-12-9

Other Registry Numbers

  • 1044805-26-6
  • 252671-92-4

Related Registry Number

  • 14096-86-7 (calcium-3/4H3PO4-5/8H2O)

System Generated Number

  • 0013767129

Molecular Formulas

Molecular Formula

  • Ca.3/4-H3-O4-P

Molecular Formula Fragments

  • Ca
  • COMPONENT
  • H3-O4-P

Structure Descriptors

InChI

1S/4Ca.3H3O4P/c;;;;3*1-5(2,3)4/h;;;;3*(H3,1,2,3,4)/q4*+2;;;/p-8

InChIKey

YIGWVOWKHUSYER-UHFFFAOYSA-F

Smiles

P([O-])([O-])([O-])=O.P([O-])([O-])([O-])=O.P([O-])([O-])(=O)O.[Ca+2].[Ca+2].[Ca+2].[Ca+2]