zinc;ethanolate;methanolate

C3H8O2Zn — CID 88666132

IUPACzinc;ethanolate;methanolate
SMILESCC[O-].C[O-].[Zn+2]
InChIInChI=1S/C2H5O.CH3O.Zn/c1-2-3;1-2;/h2H2,1H3;1H3;/q2*-1;+2
InChIKeyQDSSXEXUMHRYDT-UHFFFAOYSA-N
MW141.48 g/mol
LogP-1.66
Rot. Bonds

About zinc;ethanolate;methanolate

zinc;ethanolate;methanolate (PubChem CID 88666132) has the molecular formula C3H8O2Zn and a molecular weight of 141.48 g/mol. Its IUPAC name is zinc;ethanolate;methanolate.

Molecular Properties

Compound Namezinc;ethanolate;methanolate
PubChem CID88666132
Molecular FormulaC3H8O2Zn
Molecular Weight141.48 g/mol
Exact Mass139.98
IUPAC Namezinc;ethanolate;methanolate
SMILESCC[O-].C[O-].[Zn+2]
InChIInChI=1S/C2H5O.CH3O.Zn/c1-2-3;1-2;/h2H2,1H3;1H3;/q2*-1;+2
InChIKeyQDSSXEXUMHRYDT-UHFFFAOYSA-N
XLogP-1.66
TPSA46.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.48
LogP ≤ 5-1.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of zinc;ethanolate;methanolate?
The IUPAC name of zinc;ethanolate;methanolate (CID 88666132) is zinc;ethanolate;methanolate.
What is the SMILES notation for zinc;ethanolate;methanolate?
The canonical SMILES for zinc;ethanolate;methanolate is CC[O-].C[O-].[Zn+2].
What is the InChIKey of zinc;ethanolate;methanolate?
The InChIKey is QDSSXEXUMHRYDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5O.CH3O.Zn/c1-2-3;1-2;/h2H2,1H3;1H3;/q2*-1;+2.
What are the key properties of zinc;ethanolate;methanolate?
zinc;ethanolate;methanolate has a molecular weight of 141.48 g/mol, XLogP of -1.66, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for zinc;ethanolate;methanolate is sourced from PubChem (CID 88666132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).