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Ferrous Ammonium Sulfate Hexahydrate
CAS: 7783-85-9 | H11FeNO7S
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
7783-85-9
Molecular Formula:
H11FeNO7S
Molecular Mass:
225.00 g/mol
Names and Synonyms:
Ferrous Ammonium Sulfate Hexahydrate
Sulfuric acid, ammonium iron(2+) salt (2:2:1), hexahydrate
Ferrous ammonium sulfate hexahydrate
Ferrous ammonium sulfate [FeSO4.(NH4)2SO4.6H2O]
Iron ammonium sulfate hydrate (FeSO4(NH4)2SO4.6H2O)
Diammonium iron(II) sulfate hexahydrate
Ammonium iron sulfate ((NH4)2Fe(SO4)2) hexahydrate
Diammonium iron disulfate hexahydrate
Diammonium iron(II) disulfate hexahydrate
Ammonium iron disulfate hexahydrate ((NH4)2Fe(SO4)2.6H2O)
Diammonium iron(2+) disulfate hexahydrate
Diammonium iron sulfate ((NH4)2Fe(SO4)2) hexahydrate
Ammonium ferrous sulfate hexahydrate
Identifiers:
SMILES:
N.O.O.O.O=S(=O)(O)O.[Fe]
InChI:
InChI=1S/Fe.H3N.H2O4S.3H2O/c;;1-5(2,3)4;;;/h;1H3;(H2,1,2,3,4);3*1H2
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.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 225.00 g/mol | CAS Common Chemistry |
| 225.0 g/mol | RDKit | |
| 224.960560192 g/mol | RDKit | |
| Canonical SMILES | [Fe].O=S(=O)(O)O.O.N | CAS Common Chemistry |
| InChI | InChI=1S/Fe.H3N.H2O4S.3H2O/c;;1-5(2,3)4;;;/h;1H3;(H2,1,2,3,4);3*1H2 | CAS Common Chemistry |
| InChI Key | InChIKey=YBQONWCXRGPZRX-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Ferrous ammonium sulfate hexahydrate | CAS Common Chemistry |
| Heavy Atom Count | 10 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 3 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 204.09999999999997 Ų | RDKit |
| LogP | -2.9674 | RDKit |
| Molar Refractivity | 30.0409 | RDKit |
