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13478-10-9 molecular structure
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λ2-iron(2+) ion tetrahydrate dichloride

ChemBase ID: 295401
Molecular Formular: Cl2FeO4
Molecular Mass: 190.7486
Monoisotopic Mass: 189.85230134
SMILES and InChIs

SMILES:
O.O.O.O.[Cl-].[Cl-].[Fe+2]
Canonical SMILES:
O.O.O.O.[Cl-].[Cl-].[Fe+2]
InChI:
InChI=1S/2ClH.Fe.4H2O/h2*1H;;4*1H2/q;;+2;;;;/p-2
InChIKey:
WSSMOXHYUFMBLS-UHFFFAOYSA-L

Cite this record

CBID:295401 http://www.chembase.cn/molecule-295401.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
λ2-iron(2+) ion tetrahydrate dichloride
IUPAC Traditional name
λ2-iron(2+) ion tetrahydrate dichloride
Synonyms
Ferrous chloride tetrahydrate
Iron(II) chloride tetrahydrate
氯化亚铁 (II) 四水合物
CAS Number
13478-10-9
EC Number
231-843-4
MDL Number
MFCD00149709
Merck Index
144043
PubChem SID
180680932
PubChem CID
6093274

DATA SOURCES

DATA SOURCES

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Data Source Data ID
PubChem 6093274 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 15.7  H Acceptors
H Donor LogD (pH = 5.5) -0.652 
LogD (pH = 7.4) -0.652  Log P -0.652 
Molar Refractivity 3.7 cm3 Polarizability 1.4714895 Å3
Polar Surface Area 25.3 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Density
1.93 expand Show data source
Storage Warning
Air Sensitive expand Show data source
RTECS
NO5600000 expand Show data source
European Hazard Symbols
Corrosive Corrosive (C) expand Show data source
X expand Show data source
UN Number
UN3260 expand Show data source
Hazard Class
8 expand Show data source
Packing Group
III expand Show data source
Risk Statements
22-34 expand Show data source
Safety Statements
26-36/37/39-45 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS05 expand Show data source
GHS07 expand Show data source
GHS Hazard statements
H314-H318-H302 expand Show data source
GHS Precautionary statements
P280-P305+P351+P338-P309-P310 expand Show data source
Purity
98% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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