butanoate;ytterbium(2+)

C8H14O4Yb — CID 88777454

IUPACbutanoate;ytterbium(2+)
SMILESCCCC(=O)[O-].CCCC(=O)[O-].[Yb+2]
InChIInChI=1S/2C4H8O2.Yb/c2*1-2-3-4(5)6;/h2*2-3H2,1H3,(H,5,6);/q;;+2/p-2
InChIKeyPOCXCGAPXMEVBB-UHFFFAOYSA-L
MW347.24 g/mol
LogP-0.93
Rot. Bonds4

About butanoate;ytterbium(2+)

butanoate;ytterbium(2+) (PubChem CID 88777454) has the molecular formula C8H14O4Yb and a molecular weight of 347.24 g/mol. Its IUPAC name is butanoate;ytterbium(2+).

Molecular Properties

Compound Namebutanoate;ytterbium(2+)
PubChem CID88777454
Molecular FormulaC8H14O4Yb
Molecular Weight347.24 g/mol
Exact Mass348.03
IUPAC Namebutanoate;ytterbium(2+)
SMILESCCCC(=O)[O-].CCCC(=O)[O-].[Yb+2]
InChIInChI=1S/2C4H8O2.Yb/c2*1-2-3-4(5)6;/h2*2-3H2,1H3,(H,5,6);/q;;+2/p-2
InChIKeyPOCXCGAPXMEVBB-UHFFFAOYSA-L
XLogP-0.93
TPSA80.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.24
LogP ≤ 5-0.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of butanoate;ytterbium(2+)?
The IUPAC name of butanoate;ytterbium(2+) (CID 88777454) is butanoate;ytterbium(2+).
What is the SMILES notation for butanoate;ytterbium(2+)?
The canonical SMILES for butanoate;ytterbium(2+) is CCCC(=O)[O-].CCCC(=O)[O-].[Yb+2].
What is the InChIKey of butanoate;ytterbium(2+)?
The InChIKey is POCXCGAPXMEVBB-UHFFFAOYSA-L. The full InChI is InChI=1S/2C4H8O2.Yb/c2*1-2-3-4(5)6;/h2*2-3H2,1H3,(H,5,6);/q;;+2/p-2.
What are the key properties of butanoate;ytterbium(2+)?
butanoate;ytterbium(2+) has a molecular weight of 347.24 g/mol, XLogP of -0.93, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for butanoate;ytterbium(2+) is sourced from PubChem (CID 88777454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).