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| CAS No.: | 1310-45-8 |
|---|---|
| Name: | Ferric subsulfate |
| Molecular Structure: | |
 |
|
| Formula: | H2Fe4O22S5 |
| Molecular Weight: | 737.71 |
| Synonyms: | 1310-45-8 |
| EINECS: | 215-179-2 |
| Density: | d25 1.548 |
| Boiling Point: | 330 °C at 760 mmHg |
| Appearance: | reddish-brown liquid |
| PSA: | 489.32000 |
| LogP: | -1.64960 |
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Specification
The Ferric subsulfate, with CAS registry number 1310-45-8, belongs to the following product category: Inorganics. It has the systematic name of iron(3+) hydroxide sulfate (4:2:5). This chemical is a kind of reddish-brown liquid. Its classification codes are Coagulants, Hematologic Agents and Hemostatics. And the chemical formula of this chemical is H2Fe4O22S5. What's more, its EINECS is 215-179-2.
Physical properties of Ferric subsulfate: (1)ACD/LogP: -1.03; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -5.53; (4)ACD/LogD (pH 7.4): -5.53; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)#H bond acceptors: 4; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 0; (10)Polar Surface Area: 82.98 Å2; (11)Enthalpy of Vaporization: 62.94 kJ/mol; (12)Boiling Point: 330 °C at 760 mmHg; (13)Vapour Pressure: 3.35E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: [Fe+3].[Fe+3].[Fe+3].[Fe+3].[O-]S(=O)(=O)[O-].[O-]S([O-])(=O)=O.[OH-].[OH-].[O-]S([O-])(=O)=O.[O-]S([O-])(=O)=O.[O-]S([O-])(=O)=O
(2)InChI: InChI=1/4Fe.5H2O4S.2H2O/c;;;;5*1-5(2,3)4;;/h;;;;5*(H2,1,2,3,4);2*1H2/q4*+3;;;;;;;/p-12
(3)InChIKey: GDPKWKCLDUOTMP-OBELOOTIAQ
(4)Std. InChI: InChI=1S/4Fe.5H2O4S.2H2O/c;;;;5*1-5(2,3)4;;/h;;;;5*(H2,1,2,3,4);2*1H2/q4*+3;;;;;;;/p-12
(5)Std. InChIKey: GDPKWKCLDUOTMP-UHFFFAOYSA-B