propan-2-ol;tris(propan-2-olate);yttrium(3+)

C12H29O4Y — CID 172780762

IUPACpropan-2-ol;tris(propan-2-olate);yttrium(3+)
SMILESCC(C)O.CC(C)[O-].CC(C)[O-].CC(C)[O-].[Y+3]
InChIInChI=1S/C3H8O.3C3H7O.Y/c4*1-3(2)4;/h3-4H,1-2H3;3*3H,1-2H3;/q;3*-1;+3
InChIKeyOFJREAJVCHTUDS-UHFFFAOYSA-N
MW326.27 g/mol
LogP-0.35
Rot. Bonds

About propan-2-ol;tris(propan-2-olate);yttrium(3+)

propan-2-ol;tris(propan-2-olate);yttrium(3+) (PubChem CID 172780762) has the molecular formula C12H29O4Y and a molecular weight of 326.27 g/mol. Its IUPAC name is propan-2-ol;tris(propan-2-olate);yttrium(3+).

Molecular Properties

Compound Namepropan-2-ol;tris(propan-2-olate);yttrium(3+)
PubChem CID172780762
Molecular FormulaC12H29O4Y
Molecular Weight326.27 g/mol
Exact Mass326.11
IUPAC Namepropan-2-ol;tris(propan-2-olate);yttrium(3+)
SMILESCC(C)O.CC(C)[O-].CC(C)[O-].CC(C)[O-].[Y+3]
InChIInChI=1S/C3H8O.3C3H7O.Y/c4*1-3(2)4;/h3-4H,1-2H3;3*3H,1-2H3;/q;3*-1;+3
InChIKeyOFJREAJVCHTUDS-UHFFFAOYSA-N
XLogP-0.35
TPSA89.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.27
LogP ≤ 5-0.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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oxygen(2-);tridecakis(propan-2-olate);pentakis(yttrium(3+))
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Indium(III) isopropoxide
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CID 25200171

Frequently Asked Questions

What is the IUPAC name of propan-2-ol;tris(propan-2-olate);yttrium(3+)?
The IUPAC name of propan-2-ol;tris(propan-2-olate);yttrium(3+) (CID 172780762) is propan-2-ol;tris(propan-2-olate);yttrium(3+).
What is the SMILES notation for propan-2-ol;tris(propan-2-olate);yttrium(3+)?
The canonical SMILES for propan-2-ol;tris(propan-2-olate);yttrium(3+) is CC(C)O.CC(C)[O-].CC(C)[O-].CC(C)[O-].[Y+3].
What is the InChIKey of propan-2-ol;tris(propan-2-olate);yttrium(3+)?
The InChIKey is OFJREAJVCHTUDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8O.3C3H7O.Y/c4*1-3(2)4;/h3-4H,1-2H3;3*3H,1-2H3;/q;3*-1;+3.
What are the key properties of propan-2-ol;tris(propan-2-olate);yttrium(3+)?
propan-2-ol;tris(propan-2-olate);yttrium(3+) has a molecular weight of 326.27 g/mol, XLogP of -0.35, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-ol;tris(propan-2-olate);yttrium(3+) is sourced from PubChem (CID 172780762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).