cobalt(2+);bis(heptanoate)

C14H26CoO4 — CID 14298657

IUPACcobalt(2+);bis(heptanoate)
SMILESCCCCCCC(=O)[O-].CCCCCCC(=O)[O-].[Co+2]
InChIInChI=1S/2C7H14O2.Co/c2*1-2-3-4-5-6-7(8)9;/h2*2-6H2,1H3,(H,8,9);/q;;+2/p-2
InChIKeyFDPHDGUADUFPHZ-UHFFFAOYSA-L
MW317.29 g/mol
LogP1.41
Rot. Bonds10

About cobalt(2+);bis(heptanoate)

cobalt(2+);bis(heptanoate) (PubChem CID 14298657) has the molecular formula C14H26CoO4 and a molecular weight of 317.29 g/mol. Its IUPAC name is cobalt(2+);bis(heptanoate).

Molecular Properties

Compound Namecobalt(2+);bis(heptanoate)
PubChem CID14298657
Molecular FormulaC14H26CoO4
Molecular Weight317.29 g/mol
Exact Mass317.12
IUPAC Namecobalt(2+);bis(heptanoate)
SMILESCCCCCCC(=O)[O-].CCCCCCC(=O)[O-].[Co+2]
InChIInChI=1S/2C7H14O2.Co/c2*1-2-3-4-5-6-7(8)9;/h2*2-6H2,1H3,(H,8,9);/q;;+2/p-2
InChIKeyFDPHDGUADUFPHZ-UHFFFAOYSA-L
XLogP1.41
TPSA80.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.29
LogP ≤ 51.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

tetrakis(cobalt(2+));octakis(decanoate)
CID 22485854
zinc;cobalt(2+);bis(octadecanoate)
CID 159850249
calcium;cobalt(2+);tetrakis(octadecanoate)
CID 163980836
bis(octadecanoate);platinum(2+)
CID 87233709
CID 23623890
CID 23623890
octadecanoate
CID 3033836
dimagnesium;octadecanoate
CID 19105820
magnesium;docosanoate;octadecanoate
CID 158868243
decanoate;lanthanum(3+)
CID 21139452
calcium;hexadecanoate;octadecanoate
CID 22065418
bis(undecanoate);zirconium(2+)
CID 18995554
manganese(2+);bis(tricosanoate)
CID 100951425

Frequently Asked Questions

What is the IUPAC name of cobalt(2+);bis(heptanoate)?
The IUPAC name of cobalt(2+);bis(heptanoate) (CID 14298657) is cobalt(2+);bis(heptanoate).
What is the SMILES notation for cobalt(2+);bis(heptanoate)?
The canonical SMILES for cobalt(2+);bis(heptanoate) is CCCCCCC(=O)[O-].CCCCCCC(=O)[O-].[Co+2].
What is the InChIKey of cobalt(2+);bis(heptanoate)?
The InChIKey is FDPHDGUADUFPHZ-UHFFFAOYSA-L. The full InChI is InChI=1S/2C7H14O2.Co/c2*1-2-3-4-5-6-7(8)9;/h2*2-6H2,1H3,(H,8,9);/q;;+2/p-2.
What are the key properties of cobalt(2+);bis(heptanoate)?
cobalt(2+);bis(heptanoate) has a molecular weight of 317.29 g/mol, XLogP of 1.41, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cobalt(2+);bis(heptanoate) is sourced from PubChem (CID 14298657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).