2-methylpropan-2-ol;zirconium

C4H10OZr — CID 25200170

IUPAC2-methylpropan-2-ol;zirconium
SMILESCC(C)(C)O.[Zr]
InChIInChI=1S/C4H10O.Zr/c1-4(2,3)5;/h5H,1-3H3;
InChIKeyFLTAFXKELXQARK-UHFFFAOYSA-N
MW165.35 g/mol
LogP0.77
Rot. Bonds

About 2-methylpropan-2-ol;zirconium

2-methylpropan-2-ol;zirconium (PubChem CID 25200170) has the molecular formula C4H10OZr and a molecular weight of 165.35 g/mol. Its IUPAC name is 2-methylpropan-2-ol;zirconium.

Molecular Properties

Compound Name2-methylpropan-2-ol;zirconium
PubChem CID25200170
Molecular FormulaC4H10OZr
Molecular Weight165.35 g/mol
Exact Mass163.98
IUPAC Name2-methylpropan-2-ol;zirconium
SMILESCC(C)(C)O.[Zr]
InChIInChI=1S/C4H10O.Zr/c1-4(2,3)5;/h5H,1-3H3;
InChIKeyFLTAFXKELXQARK-UHFFFAOYSA-N
XLogP0.77
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.35
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methylpropan-2-ol;zirconium?
The IUPAC name of 2-methylpropan-2-ol;zirconium (CID 25200170) is 2-methylpropan-2-ol;zirconium.
What is the SMILES notation for 2-methylpropan-2-ol;zirconium?
The canonical SMILES for 2-methylpropan-2-ol;zirconium is CC(C)(C)O.[Zr].
What is the InChIKey of 2-methylpropan-2-ol;zirconium?
The InChIKey is FLTAFXKELXQARK-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O.Zr/c1-4(2,3)5;/h5H,1-3H3;.
What are the key properties of 2-methylpropan-2-ol;zirconium?
2-methylpropan-2-ol;zirconium has a molecular weight of 165.35 g/mol, XLogP of 0.77, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpropan-2-ol;zirconium is sourced from PubChem (CID 25200170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).