Calcium phytate

Base Information

• Chemical Name: Calcium phytate
• CAS No.: 7776-28-5
• Molecular Formula: C6H6Ca6O24P6
• Molecular Weight: 888.41
• European Community (EC) Number: 231-897-9,222-798-1
• UNII: L1WK0T5S7Z
• DSSTox Substance ID: DTXSID40998952
• Nikkaji Number: J326.559E
• Wikidata: Q27282591
• Mol file: 7776-28-5.mol

Synonyms:Acid, Phytic;Calcium Phytate;Hexakisphosphate, Inositol;Hexaphosphate, Inositol;Inositol Hexakisphosphate;Inositol Hexaphosphate;Phytate;Phytate, Calcium;Phytate, Sodium;Phytic Acid;Phytin;Sodium Phytate

Chemical Property of Calcium phytate

Chemical Property:

• Appearance/Colour: white powder
• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 1190.7ºC at 760 mmHg
• Flash Point: 673.9ºC
• PSA: 493.38000
• LogP: 2.12580
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 24
• Rotatable Bond Count: 6
• Exact Mass: 887.543018
• Heavy Atom Count: 42
• Complexity: 749

Purity/Quality:

99% ^*data from raw suppliers

CalciumPhytate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: Other Uses -> Food Additives
• Canonical SMILES: C1(C(C(C(C(C1OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2]

Technology Process of Calcium phytate

There total 1 articles about Calcium phytate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

sodium inositol hexaphosphate (17211-15-3) → hexacalcium myo-inositol hexakis(phosphate) (7776-28-5)

Guidance literature:

With calcium chloride; In water; pH 8;

DOI:10.1021/ja00529a043

upstream raw materials:

sodium inositol hexaphosphate

Refernces