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Potassium ferrocyanide trihydrate

CAT: 0862-GK0288-100gSize: 100 gDry Ice: NoHazardous: No
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CAT#:0862-GK0288-100gSize:100 g
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CAS Number
14459-95-1
EC Number
237-722-2
MDL Number
MFCD00167023
HS Code
28372000
Purity
98.50%
Molecular Formula
K4Fe (CN) 6 · 3H2O
Molecular Weight
422.39
Storage Conditions
+20°C
Hazardous Class
Not hazardous

Chemical Information

Potassium ferrocyanide trihydrate

See also: Potassium Cation (has active moiety).

CAS Number14459-95-1
PubChem CID161067
IUPAC Nametetrapotassium;iron(2+);hexacyanide;trihydrate
Molecular FormulaC6H6FeK4N6O3
Molecular Weight422.39
Topological Polar Surface Area146
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count15
Rotatable Bond Count0
Heavy Atom Count20
Formal Charge0
Complexity10
SMILES
[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.O.O.O.[K+].[K+].[K+].[K+].[Fe+2]
InChI
InChI=1S/6CN.Fe.4K.3H2O/c6*1-2;;;;;;;;/h;;;;;;;;;;;3*1H2/q6*-1;+2;4*+1;;;
InChIKey
UTYXJYFJPBYDKY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Potassium ferrocyanide trihydrate
CAS: 14459-95-1
CID: 161067
Formula: C6H6FeK4N6O3
MW: 422.39
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight422.39
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count15
Rotatable Bond Count0
Exact Mass421.839900
Monoisotopic Mass421.839900
Topological Polar Surface Area146 Ų
Heavy Atom Count20
Formal Charge0
Complexity10
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count14
Compound Is CanonicalizedYes