cobalt(2+);bis(2-ethylhexanoate)

C16H30CoO4 — CID 8696

IUPACcobalt(2+);bis(2-ethylhexanoate)
SMILESCCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Co+2]
InChIInChI=1S/2C8H16O2.Co/c2*1-3-5-6-7(4-2)8(9)10;/h2*7H,3-6H2,1-2H3,(H,9,10);/q;;+2/p-2
InChIKeyQAEKNCDIHIGLFI-UHFFFAOYSA-L
MW345.35 g/mol
LogP1.90
Rot. Bonds10

About cobalt(2+);bis(2-ethylhexanoate)

cobalt(2+);bis(2-ethylhexanoate) (PubChem CID 8696) has the molecular formula C16H30CoO4 and a molecular weight of 345.35 g/mol. Its IUPAC name is cobalt(2+);bis(2-ethylhexanoate).

Molecular Properties

Compound Namecobalt(2+);bis(2-ethylhexanoate)
PubChem CID8696
Molecular FormulaC16H30CoO4
Molecular Weight345.35 g/mol
Exact Mass345.15
IUPAC Namecobalt(2+);bis(2-ethylhexanoate)
SMILESCCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Co+2]
InChIInChI=1S/2C8H16O2.Co/c2*1-3-5-6-7(4-2)8(9)10;/h2*7H,3-6H2,1-2H3,(H,9,10);/q;;+2/p-2
InChIKeyQAEKNCDIHIGLFI-UHFFFAOYSA-L
XLogP1.90
TPSA80.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.35
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of cobalt(2+);bis(2-ethylhexanoate)?
The IUPAC name of cobalt(2+);bis(2-ethylhexanoate) (CID 8696) is cobalt(2+);bis(2-ethylhexanoate).
What is the SMILES notation for cobalt(2+);bis(2-ethylhexanoate)?
The canonical SMILES for cobalt(2+);bis(2-ethylhexanoate) is CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Co+2].
What is the InChIKey of cobalt(2+);bis(2-ethylhexanoate)?
The InChIKey is QAEKNCDIHIGLFI-UHFFFAOYSA-L. The full InChI is InChI=1S/2C8H16O2.Co/c2*1-3-5-6-7(4-2)8(9)10;/h2*7H,3-6H2,1-2H3,(H,9,10);/q;;+2/p-2.
What are the key properties of cobalt(2+);bis(2-ethylhexanoate)?
cobalt(2+);bis(2-ethylhexanoate) has a molecular weight of 345.35 g/mol, XLogP of 1.90, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cobalt(2+);bis(2-ethylhexanoate) is sourced from PubChem (CID 8696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).