Monoferric Phytate
[CAS# 23567-85-3]

Identification

• Name: Monoferric Phytate
• Synonyms: Ferric (2,3,4,5,6-Pentaphosphonooxycyclohexyl) Dihydrogen Phosphate; Fe-Insp6; Ferric Myo-Inositol Hexakisphosphate
• Molecular Formula: C₆H₁₈FeO₂₄P₆
• Molecular Weight: 715.88
• CAS Registry Number: 23567-85-3
• SMILES: O=[P](OC1C(O[P](O)(O)=O)C(O[P](O)(O)=O)C(O[P](O)(O)=O)C(O[P](O)(O)=O)C1O[P](O)(O)=O)(O)O.[Fe+3]
• InChI: 1S/C6H18O24P6.Fe/c7-31(8,9)25-1-2(26-32(10,11)12)4(28-34(16,17)18)6(30-36(22,23)24)5(29-35(19,20)21)3(1)27-33(13,14)15;/h1-6H,(H2,7,8,9)(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)(H2,19,20,21)(H2,22,23,24);/q;+3
• InChIKey: RRALFRRRKZGFRV-UHFFFAOYSA-N

Properties

• Boiling point: 1190.7°C at 760 mmHg (Cal.)
• Flash point: 673.9°C (Cal.)