oxolane;palladium(2+);diacetate

C8H14O5Pd — CID 173243487

IUPACoxolane;palladium(2+);diacetate
SMILESC1CCOC1.CC(=O)[O-].CC(=O)[O-].[Pd+2]
InChIInChI=1S/C4H8O.2C2H4O2.Pd/c1-2-4-5-3-1;2*1-2(3)4;/h1-4H2;2*1H3,(H,3,4);/q;;;+2/p-2
InChIKeyZUOUXBJBIIANSB-UHFFFAOYSA-L
MW296.62 g/mol
LogP-1.69
Rot. Bonds

About oxolane;palladium(2+);diacetate

oxolane;palladium(2+);diacetate (PubChem CID 173243487) has the molecular formula C8H14O5Pd and a molecular weight of 296.62 g/mol. Its IUPAC name is oxolane;palladium(2+);diacetate.

Molecular Properties

Compound Nameoxolane;palladium(2+);diacetate
PubChem CID173243487
Molecular FormulaC8H14O5Pd
Molecular Weight296.62 g/mol
Exact Mass295.99
IUPAC Nameoxolane;palladium(2+);diacetate
SMILESC1CCOC1.CC(=O)[O-].CC(=O)[O-].[Pd+2]
InChIInChI=1S/C4H8O.2C2H4O2.Pd/c1-2-4-5-3-1;2*1-2(3)4;/h1-4H2;2*1H3,(H,3,4);/q;;;+2/p-2
InChIKeyZUOUXBJBIIANSB-UHFFFAOYSA-L
XLogP-1.69
TPSA89.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.62
LogP ≤ 5-1.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of oxolane;palladium(2+);diacetate?
The IUPAC name of oxolane;palladium(2+);diacetate (CID 173243487) is oxolane;palladium(2+);diacetate.
What is the SMILES notation for oxolane;palladium(2+);diacetate?
The canonical SMILES for oxolane;palladium(2+);diacetate is C1CCOC1.CC(=O)[O-].CC(=O)[O-].[Pd+2].
What is the InChIKey of oxolane;palladium(2+);diacetate?
The InChIKey is ZUOUXBJBIIANSB-UHFFFAOYSA-L. The full InChI is InChI=1S/C4H8O.2C2H4O2.Pd/c1-2-4-5-3-1;2*1-2(3)4;/h1-4H2;2*1H3,(H,3,4);/q;;;+2/p-2.
What are the key properties of oxolane;palladium(2+);diacetate?
oxolane;palladium(2+);diacetate has a molecular weight of 296.62 g/mol, XLogP of -1.69, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for oxolane;palladium(2+);diacetate is sourced from PubChem (CID 173243487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).