2-ethylhexanoic acid;palladium(2+)

C8H16O2Pd+2 — CID 18629949

IUPAC2-ethylhexanoic acid;palladium(2+)
SMILESCCCCC(CC)C(=O)O.[Pd+2]
InChIInChI=1S/C8H16O2.Pd/c1-3-5-6-7(4-2)8(9)10;/h7H,3-6H2,1-2H3,(H,9,10);/q;+2
InChIKeyUSUJPXZHJSGRSD-UHFFFAOYSA-N
MW250.63 g/mol
LogP2.28
Rot. Bonds5

About 2-ethylhexanoic acid;palladium(2+)

2-ethylhexanoic acid;palladium(2+) (PubChem CID 18629949) has the molecular formula C8H16O2Pd+2 and a molecular weight of 250.63 g/mol. Its IUPAC name is 2-ethylhexanoic acid;palladium(2+).

Molecular Properties

Compound Name2-ethylhexanoic acid;palladium(2+)
PubChem CID18629949
Molecular FormulaC8H16O2Pd+2
Molecular Weight250.63 g/mol
Exact Mass250.02
IUPAC Name2-ethylhexanoic acid;palladium(2+)
SMILESCCCCC(CC)C(=O)O.[Pd+2]
InChIInChI=1S/C8H16O2.Pd/c1-3-5-6-7(4-2)8(9)10;/h7H,3-6H2,1-2H3,(H,9,10);/q;+2
InChIKeyUSUJPXZHJSGRSD-UHFFFAOYSA-N
XLogP2.28
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.63
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-ethylhexanoic acid;palladium(2+)?
The IUPAC name of 2-ethylhexanoic acid;palladium(2+) (CID 18629949) is 2-ethylhexanoic acid;palladium(2+).
What is the SMILES notation for 2-ethylhexanoic acid;palladium(2+)?
The canonical SMILES for 2-ethylhexanoic acid;palladium(2+) is CCCCC(CC)C(=O)O.[Pd+2].
What is the InChIKey of 2-ethylhexanoic acid;palladium(2+)?
The InChIKey is USUJPXZHJSGRSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O2.Pd/c1-3-5-6-7(4-2)8(9)10;/h7H,3-6H2,1-2H3,(H,9,10);/q;+2.
What are the key properties of 2-ethylhexanoic acid;palladium(2+)?
2-ethylhexanoic acid;palladium(2+) has a molecular weight of 250.63 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethylhexanoic acid;palladium(2+) is sourced from PubChem (CID 18629949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).