Back to Search
Molecule
Ferrous Chloride Tetrahydrate
CAS: 13478-10-9 · H8Cl2FeO4
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 13478-10-9
- Molecular Formula
- H8Cl2FeO4
- Molecular Mass
- 198.81 g/mol
Identifiers
CAS Registry Number
13478-10-9
SMILES
O.O.O.O.[Cl-].[Cl-].[Fe+2]
InChI Key
WSSMOXHYUFMBLS-UHFFFAOYSA-L
InChI
InChI=1S/2ClH.Fe.4H2O/h2*1H;;4*1H2/q;;+2;;;;/p-2
Names and Synonyms
- Ferrous Chloride Tetrahydrate Synonym
- Iron, dichloro-, hydrate (1:4) Synonym
- Iron chloride (FeCl2), tetrahydrate Synonym
- Ferrous chloride tetrahydrate Synonym
- Iron dichloride tetrahydrate Synonym
- Iron(II) chloride tetrahydrate Synonym
- Iron chloride tetrahydrate Synonym
- FeCl2·4H2O Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Wikipedia Url | https://en.wikipedia.org/wiki/Iron(II)_chloride_tetrahydrate | CAS Common Chemistry |
| Molecular Mass | 198.81 g/mol | CAS Common Chemistry |
| 198.811 g/mol | RDKit | |
| 202.837 g/mol | chempirical lib | |
| Canonical SMILES | Cl[Fe]Cl.O | CAS Common Chemistry |
| InChI | InChI=1S/2ClH.Fe.4H2O/h2*1H;;4*1H2/q;;+2;;;;/p-2 | CAS Common Chemistry |
| InChI Key | InChIKey=WSSMOXHYUFMBLS-UHFFFAOYSA-L | CAS Common Chemistry |
| Name | Ferrous chloride tetrahydrate | CAS Common Chemistry |
| Heavy Atom Count | 7 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 126.0 Ų | RDKit |
| LogP | -9.293299999999999 | RDKit |
| -9.2933 | RDKit | |
| Molar Refractivity | 14.455199999999998 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 197.914901596 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
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
Convert
Quick conversion
MW = 198.81 g/mol. Edit any field — others recompute live.
