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Iron(Iii) Sulfate

CAS: 10028-22-5 | H2FeO4S

2D Structure

3D Structure

Loading 3D structure...

Basic Information

CAS Registry Number: 10028-22-5
Molecular Formula: H2FeO4S
Molecular Mass: 153.92 g/mol

Names and Synonyms:

Iron(Iii) Sulfate
Sulfuric acid, iron(3+) salt (3:2)
Iron sulfate (Fe2(SO4)3)
Ferric sulfate
Iron persulfate
Iron sesquisulfate
Iron(III) sulfate
Diiron trisulfate
Iron sulfate (2:3)
Iron(3+) sulfate
Diiron(3+) sulfate
Amersep 5320
PIX 115
ViscoStat
FS-Pix
PIX 123
PIX 112
Stat Gel

Identifiers:

SMILES:
O=S(=O)(O)O.[Fe]
InChI:
InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)

Key Properties

Boiling Point
101-118 °C @ Press: 760 Torr CAS Common Chemistry
Melting Point
480 °C (decomp) CAS Common Chemistry
Density
3.10 g/cm³ CAS Common Chemistry

Spectral Data

NMR, IR, and Mass spectral data

1H NMR
13C NMR
Predicting NMR spectra...
10 ppm 9 8 7 6 5 4 3 2 1 0 ppm
Shift (ppm) Multiplicity Integration Assignment
200 ppm 180 160 140 120 100 80 60 40 20 0 ppm
Shift (ppm) DEPT Assignment

Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.

External Resources

All Properties

Comprehensive physical and chemical properties

Property Value Source
Molecular Mass 153.92 g/mol CAS Common Chemistry
153.92399999999998 g/mol RDKit
153.902317044 g/mol RDKit
Density 3.10 g/cm³ CAS Common Chemistry
3.097 g/cm3 @ Temp: 18 °C CAS Common Chemistry
Wikipedia Url https://en.wikipedia.org/wiki/Iron(III)_sulfate CAS Common Chemistry
Boiling Point 101-118 °C @ Press: 760 Torr CAS Common Chemistry
Canonical SMILES [Fe].O=S(=O)(O)O CAS Common Chemistry
InChI InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4) CAS Common Chemistry
InChI Key InChIKey=MVZXTUSAYBWAAM-UHFFFAOYSA-N CAS Common Chemistry
Melting Point 480 °C (decomp) CAS Common Chemistry
Name Ferric sulfate CAS Common Chemistry
Iron(III) sulfate CAS Common Chemistry
Heavy Atom Count 6 RDKit
Hydrogen Bond Acceptors 2 RDKit
Hydrogen Bond Donors 2 RDKit
Rotatable Bonds 0 RDKit
Aromatic Ring Count 0 RDKit
Topological Polar Surface Area 74.60000000000001 Ų RDKit
LogP -0.6552999999999998 RDKit
Molar Refractivity 14.1774 RDKit

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