copper;sulfate;hexahydrate

H12CuO10S — CID 22348481

IUPACcopper;sulfate;hexahydrate
SMILESO.O.O.O.O.O.O=S(=O)([O-])[O-].[Cu+2]
InChIInChI=1S/Cu.H2O4S.6H2O/c;1-5(2,3)4;;;;;;/h;(H2,1,2,3,4);6*1H2/q+2;;;;;;;/p-2
InChIKeyKDBQRAGSEVVHSN-UHFFFAOYSA-L
MW267.70 g/mol
LogP-6.29
Rot. Bonds

About copper;sulfate;hexahydrate

copper;sulfate;hexahydrate (PubChem CID 22348481) has the molecular formula H12CuO10S and a molecular weight of 267.70 g/mol. Its IUPAC name is copper;sulfate;hexahydrate.

Molecular Properties

Compound Namecopper;sulfate;hexahydrate
PubChem CID22348481
Molecular FormulaH12CuO10S
Molecular Weight267.70 g/mol
Exact Mass266.94
IUPAC Namecopper;sulfate;hexahydrate
SMILESO.O.O.O.O.O.O=S(=O)([O-])[O-].[Cu+2]
InChIInChI=1S/Cu.H2O4S.6H2O/c;1-5(2,3)4;;;;;;/h;(H2,1,2,3,4);6*1H2/q+2;;;;;;;/p-2
InChIKeyKDBQRAGSEVVHSN-UHFFFAOYSA-L
XLogP-6.29
TPSA269.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.70
LogP ≤ 5-6.29
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

copper;disulfate;hydrate
CID 44601134
copper;silane;sulfate;pentahydrate
CID 174899349
octacosacopper;pentasulfate
CID 173053964
sulfate trihydrate
CID 22613957
bis(iron(3+));trisulfate;tetrahydrate
CID 138961463
bis(iron(3+));trisulfate;henicosahydrate
CID 173056972
copper;sulfate;hydrofluoride
CID 158262583
copper;tetrasodium;trisulfate
CID 158226440
tris(ytterbium(3+));disulfate;octahydrate
CID 131676103
sodium;sulfate;heptahydrate
CID 18522796
dialuminum;trisulfate;dotriacontahydrate
CID 172707347
bis(ytterbium(3+));trisulfate;octahydrate
CID 25022290

Frequently Asked Questions

What is the IUPAC name of copper;sulfate;hexahydrate?
The IUPAC name of copper;sulfate;hexahydrate (CID 22348481) is copper;sulfate;hexahydrate.
What is the SMILES notation for copper;sulfate;hexahydrate?
The canonical SMILES for copper;sulfate;hexahydrate is O.O.O.O.O.O.O=S(=O)([O-])[O-].[Cu+2].
What is the InChIKey of copper;sulfate;hexahydrate?
The InChIKey is KDBQRAGSEVVHSN-UHFFFAOYSA-L. The full InChI is InChI=1S/Cu.H2O4S.6H2O/c;1-5(2,3)4;;;;;;/h;(H2,1,2,3,4);6*1H2/q+2;;;;;;;/p-2.
What are the key properties of copper;sulfate;hexahydrate?
copper;sulfate;hexahydrate has a molecular weight of 267.70 g/mol, XLogP of -6.29, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for copper;sulfate;hexahydrate is sourced from PubChem (CID 22348481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).