zinc;hydrogen sulfate;cyanide

CHNO4SZn — CID 88619780

IUPACzinc;hydrogen sulfate;cyanide
SMILESO=S(=O)([O-])O.[C-]#N.[Zn+2]
InChIInChI=1S/CN.H2O4S.Zn/c1-2;1-5(2,3)4;/h;(H2,1,2,3,4);/q-1;;+2/p-1
InChIKeyHVQJFNMDYCCIIW-UHFFFAOYSA-M
MW188.48 g/mol
LogP-0.90
Rot. Bonds

About zinc;hydrogen sulfate;cyanide

zinc;hydrogen sulfate;cyanide (PubChem CID 88619780) has the molecular formula CHNO4SZn and a molecular weight of 188.48 g/mol. Its IUPAC name is zinc;hydrogen sulfate;cyanide.

Molecular Properties

Compound Namezinc;hydrogen sulfate;cyanide
PubChem CID88619780
Molecular FormulaCHNO4SZn
Molecular Weight188.48 g/mol
Exact Mass186.89
IUPAC Namezinc;hydrogen sulfate;cyanide
SMILESO=S(=O)([O-])O.[C-]#N.[Zn+2]
InChIInChI=1S/CN.H2O4S.Zn/c1-2;1-5(2,3)4;/h;(H2,1,2,3,4);/q-1;;+2/p-1
InChIKeyHVQJFNMDYCCIIW-UHFFFAOYSA-M
XLogP-0.90
TPSA101.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.48
LogP ≤ 5-0.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'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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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of zinc;hydrogen sulfate;cyanide?
The IUPAC name of zinc;hydrogen sulfate;cyanide (CID 88619780) is zinc;hydrogen sulfate;cyanide.
What is the SMILES notation for zinc;hydrogen sulfate;cyanide?
The canonical SMILES for zinc;hydrogen sulfate;cyanide is O=S(=O)([O-])O.[C-]#N.[Zn+2].
What is the InChIKey of zinc;hydrogen sulfate;cyanide?
The InChIKey is HVQJFNMDYCCIIW-UHFFFAOYSA-M. The full InChI is InChI=1S/CN.H2O4S.Zn/c1-2;1-5(2,3)4;/h;(H2,1,2,3,4);/q-1;;+2/p-1.
What are the key properties of zinc;hydrogen sulfate;cyanide?
zinc;hydrogen sulfate;cyanide has a molecular weight of 188.48 g/mol, XLogP of -0.90, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for zinc;hydrogen sulfate;cyanide is sourced from PubChem (CID 88619780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).