zinc bis(2-hydroxyacetate)

C4H6O6Zn — CID 15245444

IUPACzinc bis(2-hydroxyacetate)
SMILESO=C([O-])CO.O=C([O-])CO.[Zn+2]
InChIInChI=1S/2C2H4O3.Zn/c2*3-1-2(4)5;/h2*3H,1H2,(H,4,5);/q;;+2/p-2
InChIKeyMCOGTQGPHPAUJN-UHFFFAOYSA-L
MW215.48 g/mol
LogP-4.55
Rot. Bonds2

About zinc bis(2-hydroxyacetate)

zinc bis(2-hydroxyacetate) (PubChem CID 15245444) has the molecular formula C4H6O6Zn and a molecular weight of 215.48 g/mol. Its IUPAC name is zinc bis(2-hydroxyacetate).

Molecular Properties

Compound Namezinc bis(2-hydroxyacetate)
PubChem CID15245444
Molecular FormulaC4H6O6Zn
Molecular Weight215.48 g/mol
Exact Mass213.95
IUPAC Namezinc bis(2-hydroxyacetate)
SMILESO=C([O-])CO.O=C([O-])CO.[Zn+2]
InChIInChI=1S/2C2H4O3.Zn/c2*3-1-2(4)5;/h2*3H,1H2,(H,4,5);/q;;+2/p-2
InChIKeyMCOGTQGPHPAUJN-UHFFFAOYSA-L
XLogP-4.55
TPSA120.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.48
LogP ≤ 5-4.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-hydroxyacetate
CID 5460308
dipotassium bis(2-hydroxyacetate)
CID 140653272
dysprosium(3+);tris(2-hydroxyacetate)
CID 158146925
tris(2-hydroxyacetate);iridium(3+)
CID 158441249
2-hydroxyacetate;iron(2+)
CID 18504415
tris(2-hydroxyacetate);yttrium(3+)
CID 161004200
magnesium;2-hydroxyacetate;chloride
CID 18799087
bis(2-hydroxyacetate);titanium(2+);dihydrate
CID 87109792
azanium;2-hydroxyacetate;titanium
CID 173336650
trisodium;tris(2-hydroxyacetate);(2-hydroxyacetic acid)
CID 173437096
disodium;2-hydroxyacetate;oxido(dioxo)tungsten
CID 88681713
2-hydroxyacetate;tri(propan-2-yl)azanium
CID 139301397

Frequently Asked Questions

What is the IUPAC name of zinc bis(2-hydroxyacetate)?
The IUPAC name of zinc bis(2-hydroxyacetate) (CID 15245444) is zinc bis(2-hydroxyacetate).
What is the SMILES notation for zinc bis(2-hydroxyacetate)?
The canonical SMILES for zinc bis(2-hydroxyacetate) is O=C([O-])CO.O=C([O-])CO.[Zn+2].
What is the InChIKey of zinc bis(2-hydroxyacetate)?
The InChIKey is MCOGTQGPHPAUJN-UHFFFAOYSA-L. The full InChI is InChI=1S/2C2H4O3.Zn/c2*3-1-2(4)5;/h2*3H,1H2,(H,4,5);/q;;+2/p-2.
What are the key properties of zinc bis(2-hydroxyacetate)?
zinc bis(2-hydroxyacetate) has a molecular weight of 215.48 g/mol, XLogP of -4.55, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for zinc bis(2-hydroxyacetate) is sourced from PubChem (CID 15245444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).