zinc;sulfuric acid;sulfate

H4O12S3Zn — CID 160674423

IUPACzinc;sulfuric acid;sulfate
SMILESO=S(=O)(O)O.O=S(=O)(O)O.O=S(=O)([O-])[O-].[Zn+2]
InChIInChI=1S/3H2O4S.Zn/c3*1-5(2,3)4;/h3*(H2,1,2,3,4);/q;;;+2/p-2
InChIKeyRNIVAZXLQZEVSO-UHFFFAOYSA-L
MW357.61 g/mol
LogP-2.65
Rot. Bonds

About zinc;sulfuric acid;sulfate

zinc;sulfuric acid;sulfate (PubChem CID 160674423) has the molecular formula H4O12S3Zn and a molecular weight of 357.61 g/mol. Its IUPAC name is zinc;sulfuric acid;sulfate.

Molecular Properties

Compound Namezinc;sulfuric acid;sulfate
PubChem CID160674423
Molecular FormulaH4O12S3Zn
Molecular Weight357.61 g/mol
Exact Mass355.82
IUPAC Namezinc;sulfuric acid;sulfate
SMILESO=S(=O)(O)O.O=S(=O)(O)O.O=S(=O)([O-])[O-].[Zn+2]
InChIInChI=1S/3H2O4S.Zn/c3*1-5(2,3)4;/h3*(H2,1,2,3,4);/q;;;+2/p-2
InChIKeyRNIVAZXLQZEVSO-UHFFFAOYSA-L
XLogP-2.65
TPSA229.46 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.61
LogP ≤ 5-2.65
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of zinc;sulfuric acid;sulfate?
The IUPAC name of zinc;sulfuric acid;sulfate (CID 160674423) is zinc;sulfuric acid;sulfate.
What is the SMILES notation for zinc;sulfuric acid;sulfate?
The canonical SMILES for zinc;sulfuric acid;sulfate is O=S(=O)(O)O.O=S(=O)(O)O.O=S(=O)([O-])[O-].[Zn+2].
What is the InChIKey of zinc;sulfuric acid;sulfate?
The InChIKey is RNIVAZXLQZEVSO-UHFFFAOYSA-L. The full InChI is InChI=1S/3H2O4S.Zn/c3*1-5(2,3)4;/h3*(H2,1,2,3,4);/q;;;+2/p-2.
What are the key properties of zinc;sulfuric acid;sulfate?
zinc;sulfuric acid;sulfate has a molecular weight of 357.61 g/mol, XLogP of -2.65, 0 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for zinc;sulfuric acid;sulfate is sourced from PubChem (CID 160674423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).