CID 175737084

H2O12S4Zn — CID 175737084

IUPAC—
SMILESO=S(=O)(O)S(=O)(=O)O.O=S(=O)([O-])S(=O)(=O)[O-].[Zn+2]
InChIInChI=1S/2H2O6S2.Zn/c2*1-7(2,3)8(4,5)6;/h2*(H,1,2,3)(H,4,5,6);/q;;+2/p-2
InChIKeyWAZRMMCZPHCRFW-UHFFFAOYSA-L
MW387.66 g/mol
LogP-3.33
Rot. Bonds2

About CID 175737084

CID 175737084 (PubChem CID 175737084) has the molecular formula H2O12S4Zn and a molecular weight of 387.66 g/mol.

Molecular Properties

Compound NameCID 175737084
PubChem CID175737084
Molecular FormulaH2O12S4Zn
Molecular Weight387.66 g/mol
Exact Mass385.77
IUPAC Name—
SMILESO=S(=O)(O)S(=O)(=O)O.O=S(=O)([O-])S(=O)(=O)[O-].[Zn+2]
InChIInChI=1S/2H2O6S2.Zn/c2*1-7(2,3)8(4,5)6;/h2*(H,1,2,3)(H,4,5,6);/q;;+2/p-2
InChIKeyWAZRMMCZPHCRFW-UHFFFAOYSA-L
XLogP-3.33
TPSA223.14 Ų
H-Bond Donors2
H-Bond Acceptors10
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.66
LogP ≤ 5-3.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

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Related Compounds

zinc;sulfuric acid;sulfate
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hydrogen sulfate;zirconium(4+)
CID 11213772
strontium hydrogen sulfate
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lithium;silver;sulfuric acid;sulfate
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zinc;hydrogen sulfate;cyanide
CID 88619780
silver;zinc;sulfate
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aluminum;zinc;hydrogen sulfate;silicate
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sulfuric acid;sulfate;heptahydrate
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Frequently Asked Questions

What is the IUPAC name of CID 175737084?
The IUPAC name of CID 175737084 (CID 175737084) is not available.
What is the SMILES notation for CID 175737084?
The canonical SMILES for CID 175737084 is O=S(=O)(O)S(=O)(=O)O.O=S(=O)([O-])S(=O)(=O)[O-].[Zn+2].
What is the InChIKey of CID 175737084?
The InChIKey is WAZRMMCZPHCRFW-UHFFFAOYSA-L. The full InChI is InChI=1S/2H2O6S2.Zn/c2*1-7(2,3)8(4,5)6;/h2*(H,1,2,3)(H,4,5,6);/q;;+2/p-2.
What are the key properties of CID 175737084?
CID 175737084 has a molecular weight of 387.66 g/mol, XLogP of -3.33, 2 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for CID 175737084 is sourced from PubChem (CID 175737084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).