potassium;chromium(2+);sulfate;dodecahydrate

H24CrKO16S+ — CID 18668487

IUPACpotassium;chromium(2+);sulfate;dodecahydrate
SMILESO.O.O.O.O.O.O.O.O.O.O.O.O=S(=O)([O-])[O-].[Cr+2].[K+]
InChIInChI=1S/Cr.K.H2O4S.12H2O/c;;1-5(2,3)4;;;;;;;;;;;;/h;;(H2,1,2,3,4);12*1H2/q+2;+1;;;;;;;;;;;;;/p-2
InChIKeyRLLHZMVWEDJFBS-UHFFFAOYSA-L
MW403.34 g/mol
LogP-14.23
Rot. Bonds

About potassium;chromium(2+);sulfate;dodecahydrate

potassium;chromium(2+);sulfate;dodecahydrate (PubChem CID 18668487) has the molecular formula H24CrKO16S+ and a molecular weight of 403.34 g/mol. Its IUPAC name is potassium;chromium(2+);sulfate;dodecahydrate.

Molecular Properties

Compound Namepotassium;chromium(2+);sulfate;dodecahydrate
PubChem CID18668487
Molecular FormulaH24CrKO16S+
Molecular Weight403.34 g/mol
Exact Mass402.98
IUPAC Namepotassium;chromium(2+);sulfate;dodecahydrate
SMILESO.O.O.O.O.O.O.O.O.O.O.O.O=S(=O)([O-])[O-].[Cr+2].[K+]
InChIInChI=1S/Cr.K.H2O4S.12H2O/c;;1-5(2,3)4;;;;;;;;;;;;/h;;(H2,1,2,3,4);12*1H2/q+2;+1;;;;;;;;;;;;;/p-2
InChIKeyRLLHZMVWEDJFBS-UHFFFAOYSA-L
XLogP-14.23
TPSA458.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.34
LogP ≤ 5-14.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}, {'alert_name': 'sulphate', 'substructure': 'N/A'}

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Related Compounds

dimagnesium;dipotassium;trisulfate;hexahydrate
CID 24848855
potassium;chromium(3+);disulfate;decahydrate
CID 172850591
sulfate trihydrate
CID 22613957
dialuminum;dipotassium;hydride;trisulfate;dihydrate
CID 173094004
bis(iron(3+));trisulfate;tetrahydrate
CID 138961463
bis(iron(3+));trisulfate;henicosahydrate
CID 173056972
dialuminum;trisulfate;dotriacontahydrate
CID 172707347
bis(ytterbium(3+));trisulfate;octahydrate
CID 25022290
tripotassium;titanium(2+);sulfate
CID 19377241
tris(ytterbium(3+));disulfate;octahydrate
CID 131676103
sodium;sulfate;heptahydrate
CID 18522796
copper;disulfate;hydrate
CID 44601134

Frequently Asked Questions

What is the IUPAC name of potassium;chromium(2+);sulfate;dodecahydrate?
The IUPAC name of potassium;chromium(2+);sulfate;dodecahydrate (CID 18668487) is potassium;chromium(2+);sulfate;dodecahydrate.
What is the SMILES notation for potassium;chromium(2+);sulfate;dodecahydrate?
The canonical SMILES for potassium;chromium(2+);sulfate;dodecahydrate is O.O.O.O.O.O.O.O.O.O.O.O.O=S(=O)([O-])[O-].[Cr+2].[K+].
What is the InChIKey of potassium;chromium(2+);sulfate;dodecahydrate?
The InChIKey is RLLHZMVWEDJFBS-UHFFFAOYSA-L. The full InChI is InChI=1S/Cr.K.H2O4S.12H2O/c;;1-5(2,3)4;;;;;;;;;;;;/h;;(H2,1,2,3,4);12*1H2/q+2;+1;;;;;;;;;;;;;/p-2.
What are the key properties of potassium;chromium(2+);sulfate;dodecahydrate?
potassium;chromium(2+);sulfate;dodecahydrate has a molecular weight of 403.34 g/mol, XLogP of -14.23, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;chromium(2+);sulfate;dodecahydrate is sourced from PubChem (CID 18668487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).