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Molecule
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
Identifiers
CAS Registry Number
7783-85-9
SMILES
N.O.O.O.O=S(=O)(O)O.[Fe]
InChI Key
YBQONWCXRGPZRX-UHFFFAOYSA-N
InChI
InChI=1S/Fe.H3N.H2O4S.3H2O/c;;1-5(2,3)4;;;/h;1H3;(H2,1,2,3,4);3*1H2
Names and Synonyms
- Ferrous Ammonium Sulfate Hexahydrate Common Name
- Sulfuric acid, ammonium iron(2+) salt (2:2:1), hexahydrate Synonym
- Ferrous ammonium sulfate hexahydrate Synonym
- Ferrous ammonium sulfate [FeSO4.(NH4)2SO4.6H2O] Synonym
- Iron ammonium sulfate hydrate (FeSO4(NH4)2SO4.6H2O) Synonym
- Diammonium iron(II) sulfate hexahydrate Synonym
- Ammonium iron sulfate ((NH4)2Fe(SO4)2) hexahydrate Synonym
- Diammonium iron disulfate hexahydrate Synonym
- Diammonium iron(II) disulfate hexahydrate Synonym
- Ammonium iron disulfate hexahydrate ((NH4)2Fe(SO4)2.6H2O) Synonym
- Diammonium iron(2+) disulfate hexahydrate Synonym
- Diammonium iron sulfate ((NH4)2Fe(SO4)2) hexahydrate Synonym
- Ammonium ferrous sulfate hexahydrate Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 225.00 g/mol | CAS Common Chemistry |
| 225.0 g/mol | RDKit | |
| 227.009 g/mol | chempirical lib | |
| 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 |
| 204.1 Ų | RDKit | |
| LogP | -2.9674 | RDKit |
| Molar Refractivity | 30.0409 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 224.960560192 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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1
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| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
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| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
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MW = 225.00 g/mol. Edit any field — others recompute live.
