2-methylpropan-1-ol;zirconium;hydrochloride

C4H11ClOZr — CID 174563411

IUPAC2-methylpropan-1-ol;zirconium;hydrochloride
SMILESCC(C)CO.Cl.[Zr]
InChIInChI=1S/C4H10O.ClH.Zr/c1-4(2)3-5;;/h4-5H,3H2,1-2H3;1H;
InChIKeyINHZVTWSKRDOPG-UHFFFAOYSA-N
MW201.81 g/mol
LogP1.05
Rot. Bonds1

About 2-methylpropan-1-ol;zirconium;hydrochloride

2-methylpropan-1-ol;zirconium;hydrochloride (PubChem CID 174563411) has the molecular formula C4H11ClOZr and a molecular weight of 201.81 g/mol. Its IUPAC name is 2-methylpropan-1-ol;zirconium;hydrochloride.

Molecular Properties

Compound Name2-methylpropan-1-ol;zirconium;hydrochloride
PubChem CID174563411
Molecular FormulaC4H11ClOZr
Molecular Weight201.81 g/mol
Exact Mass199.95
IUPAC Name2-methylpropan-1-ol;zirconium;hydrochloride
SMILESCC(C)CO.Cl.[Zr]
InChIInChI=1S/C4H10O.ClH.Zr/c1-4(2)3-5;;/h4-5H,3H2,1-2H3;1H;
InChIKeyINHZVTWSKRDOPG-UHFFFAOYSA-N
XLogP1.05
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.81
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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tris(2-methylpropan-1-ol);titanium
CID 87503095
CID 131872176
CID 131872176
2-methylpropan-1-ol;zinc
CID 151745482
azane;tris(2-methylpropan-1-ol)
CID 175819145
2-methylpropan-1-ol;zirconium(3+)
CID 150803706
lanthanum;tris(2-methylpropan-1-ol)
CID 140708551
sodium;2-methylpropan-1-ol;chloride
CID 172733950
chloroform;2-methylpropan-1-ol
CID 22625576
bis(2-methylpropan-1-ol);bis(propan-2-ol);titanium
CID 22628754
2,2-dimethylpropane;2-methylpropan-1-ol
CID 158369394

Frequently Asked Questions

What is the IUPAC name of 2-methylpropan-1-ol;zirconium;hydrochloride?
The IUPAC name of 2-methylpropan-1-ol;zirconium;hydrochloride (CID 174563411) is 2-methylpropan-1-ol;zirconium;hydrochloride.
What is the SMILES notation for 2-methylpropan-1-ol;zirconium;hydrochloride?
The canonical SMILES for 2-methylpropan-1-ol;zirconium;hydrochloride is CC(C)CO.Cl.[Zr].
What is the InChIKey of 2-methylpropan-1-ol;zirconium;hydrochloride?
The InChIKey is INHZVTWSKRDOPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O.ClH.Zr/c1-4(2)3-5;;/h4-5H,3H2,1-2H3;1H;.
What are the key properties of 2-methylpropan-1-ol;zirconium;hydrochloride?
2-methylpropan-1-ol;zirconium;hydrochloride has a molecular weight of 201.81 g/mol, XLogP of 1.05, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpropan-1-ol;zirconium;hydrochloride is sourced from PubChem (CID 174563411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).