Introduction：Basic information about CAS 7776-28-5|phytin, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | phytin |
|---|
| CAS Number | 7776-28-5 | Molecular Weight | 888.408 |
|---|
| Density | / | Boiling Point | 1190.7ºC at 760 mmHg |
|---|
| Molecular Formula | C6H6Ca6O24P6 | Melting Point | / |
|---|
| MSDS | / | Flash Point | 673.9ºC |
|---|
Names
| Name | hexacalcium,(2,3,4,5,6-pentaphosphonatooxycyclohexyl) phosphate |
|---|
| Synonym | More Synonyms |
|---|
Chemical & Physical Properties
| Boiling Point | 1190.7ºC at 760 mmHg |
|---|
| Molecular Formula | C6H6Ca6O24P6 |
|---|
| Molecular Weight | 888.408 |
|---|
| Flash Point | 673.9ºC |
|---|
| Exact Mass | 887.543030 |
|---|
| PSA | 493.38000 |
|---|
| LogP | 2.12580 |
|---|
| InChIKey | WPEXVRDUEAJUGY-UHFFFAOYSA-B |
|---|
| SMILES | O=P([O-])([O-])OC1C(OP(=O)([O-])[O-])C(OP(=O)([O-])[O-])C(OP(=O)([O-])[O-])C(OP(=O)([O-])[O-])C1OP(=O)([O-])[O-].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2] |
|---|
Synonyms
| Hexacalcium phytate |
| hexacalcium myo-inositol hexakis(phosphate) |
| Inositol hexaphosphate calcium salt |
| CALCIUM PHYTATE |
| UNII-L1WK0T5S7Z |
| EINECS 231-897-9 |
| calcium fytate |
| EINECS 222-798-1 |
