acetic acid;diiodopalladium

C2H4I2O2Pd — CID 156635301

IUPACacetic acid;diiodopalladium
SMILESCC(=O)O.I[Pd]I
InChIInChI=1S/C2H4O2.2HI.Pd/c1-2(3)4;;;/h1H3,(H,3,4);2*1H;/q;;;+2/p-2
InChIKeyPBFZOBLCIQWCAI-UHFFFAOYSA-L
MW420.28 g/mol
LogP1.86
Rot. Bonds

About acetic acid;diiodopalladium

acetic acid;diiodopalladium (PubChem CID 156635301) has the molecular formula C2H4I2O2Pd and a molecular weight of 420.28 g/mol. Its IUPAC name is acetic acid;diiodopalladium.

Molecular Properties

Compound Nameacetic acid;diiodopalladium
PubChem CID156635301
Molecular FormulaC2H4I2O2Pd
Molecular Weight420.28 g/mol
Exact Mass419.73
IUPAC Nameacetic acid;diiodopalladium
SMILESCC(=O)O.I[Pd]I
InChIInChI=1S/C2H4O2.2HI.Pd/c1-2(3)4;;;/h1H3,(H,3,4);2*1H;/q;;;+2/p-2
InChIKeyPBFZOBLCIQWCAI-UHFFFAOYSA-L
XLogP1.86
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.28
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of acetic acid;diiodopalladium?
The IUPAC name of acetic acid;diiodopalladium (CID 156635301) is acetic acid;diiodopalladium.
What is the SMILES notation for acetic acid;diiodopalladium?
The canonical SMILES for acetic acid;diiodopalladium is CC(=O)O.I[Pd]I.
What is the InChIKey of acetic acid;diiodopalladium?
The InChIKey is PBFZOBLCIQWCAI-UHFFFAOYSA-L. The full InChI is InChI=1S/C2H4O2.2HI.Pd/c1-2(3)4;;;/h1H3,(H,3,4);2*1H;/q;;;+2/p-2.
What are the key properties of acetic acid;diiodopalladium?
acetic acid;diiodopalladium has a molecular weight of 420.28 g/mol, XLogP of 1.86, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for acetic acid;diiodopalladium is sourced from PubChem (CID 156635301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).