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15819-50-8

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Basic Information
CAS No.: 15819-50-8
Name: TRI-SODIUM PHOSPHATE HEXAHYDRATE
Molecular Structure:
Molecular Structure of 15819-50-8 (TRI-SODIUM PHOSPHATE HEXAHYDRATE)
Formula: Na3PO4.6(H2O)
Molecular Weight: 272.03
Synonyms: Sodiumphosphate (Na3PO4) hexahydrate;
Boiling Point: 158 °C at 760 mmHg
Hazard Symbols: C
Risk Codes: 34
Safety: 26-36/37/39-45
PSA: 151.44000
LogP: 0.00020
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Specification

The Trisodium phosphate hexahydrate, with CAS registry number 15819-50-8, has the systematic name of sodium phosphate hydrate (3:1:6). Besides this, it is also called Tri-Sodium phosphate hexahydrate. And the chemical formula of this chemical is Na3PO4.6(H2O).

Physical properties of Trisodium phosphate hexahydrate: (1)ACD/LogP: -2.15; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 0; (6)Polar Surface Area: 87.57 Å2; (7)Boiling Point: 158 °C at 760 mmHg; (8)Vapour Pressure: 1.41 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: [Na+].[Na+].[Na+].[O-]P([O-])([O-])=O.O.O.O.O.O.O
(2)InChI: InChI=1/3Na.H3O4P.6H2O/c;;;1-5(2,3)4;;;;;;/h;;;(H3,1,2,3,4);6*1H2/q3*+1;;;;;;;/p-3
(3)InChIKey: BPFZWBABAJEKEO-DFZHHIFOAQ
(4)Std. InChI: InChI=1S/3Na.H3O4P.6H2O/c;;;1-5(2,3)4;;;;;;/h;;;(H3,1,2,3,4);6*1H2/q3*+1;;;;;;;/p-3
(5)Std. InChIKey: BPFZWBABAJEKEO-UHFFFAOYSA-K