acetic acid;yttrium(3+);triacetate

C8H13O8Y — CID 175880904

IUPACacetic acid;yttrium(3+);triacetate
SMILESCC(=O)O.CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Y+3]
InChIInChI=1S/4C2H4O2.Y/c4*1-2(3)4;/h4*1H3,(H,3,4);/q;;;;+3/p-3
InChIKeyYLHBTSXESZEHJQ-UHFFFAOYSA-K
MW326.09 g/mol
LogP-3.64
Rot. Bonds

About acetic acid;yttrium(3+);triacetate

acetic acid;yttrium(3+);triacetate (PubChem CID 175880904) has the molecular formula C8H13O8Y and a molecular weight of 326.09 g/mol. Its IUPAC name is acetic acid;yttrium(3+);triacetate.

Molecular Properties

Compound Nameacetic acid;yttrium(3+);triacetate
PubChem CID175880904
Molecular FormulaC8H13O8Y
Molecular Weight326.09 g/mol
Exact Mass325.97
IUPAC Nameacetic acid;yttrium(3+);triacetate
SMILESCC(=O)O.CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Y+3]
InChIInChI=1S/4C2H4O2.Y/c4*1-2(3)4;/h4*1H3,(H,3,4);/q;;;;+3/p-3
InChIKeyYLHBTSXESZEHJQ-UHFFFAOYSA-K
XLogP-3.64
TPSA157.69 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.09
LogP ≤ 5-3.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

acetic acid;iron(3+);triacetate
CID 175778067
dipotassium;acetic acid;diacetate
CID 158588749
cesium;acetic acid;acetate
CID 175712747
disodium;acetic acid;diacetate
CID 173429672
tetrasodium;acetic acid;tetraacetate
CID 175423347
sodium;acetic acid;acetate
CID 173223990
acetic acid;nickel(2+);diacetate
CID 159615318
disodium;acetic acid;diacetate;dihydrate
CID 157440241
potassium;acetic acid;phosphane;acetate
CID 172706632
lithium;acetic acid;palladium;acetate
CID 154700306
yttrium(3+);triacetate;hydrate
CID 57376990
bis(yttrium(3+));diacetate;tetrahydrate
CID 161152203

Frequently Asked Questions

What is the IUPAC name of acetic acid;yttrium(3+);triacetate?
The IUPAC name of acetic acid;yttrium(3+);triacetate (CID 175880904) is acetic acid;yttrium(3+);triacetate.
What is the SMILES notation for acetic acid;yttrium(3+);triacetate?
The canonical SMILES for acetic acid;yttrium(3+);triacetate is CC(=O)O.CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Y+3].
What is the InChIKey of acetic acid;yttrium(3+);triacetate?
The InChIKey is YLHBTSXESZEHJQ-UHFFFAOYSA-K. The full InChI is InChI=1S/4C2H4O2.Y/c4*1-2(3)4;/h4*1H3,(H,3,4);/q;;;;+3/p-3.
What are the key properties of acetic acid;yttrium(3+);triacetate?
acetic acid;yttrium(3+);triacetate has a molecular weight of 326.09 g/mol, XLogP of -3.64, 0 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for acetic acid;yttrium(3+);triacetate is sourced from PubChem (CID 175880904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).