hydroxy-dimethyl-[(2-methylpropan-2-yl)oxy]silane;zirconium

C6H16O2SiZr — CID 18689460

IUPAChydroxy-dimethyl-[(2-methylpropan-2-yl)oxy]silane;zirconium
SMILESCC(C)(C)O[Si](C)(C)O.[Zr]
InChIInChI=1S/C6H16O2Si.Zr/c1-6(2,3)8-9(4,5)7;/h7H,1-5H3;
InChIKeyYLWXIKLJTGIDKJ-UHFFFAOYSA-N
MW239.50 g/mol
LogP1.49
Rot. Bonds1

About hydroxy-dimethyl-[(2-methylpropan-2-yl)oxy]silane;zirconium

hydroxy-dimethyl-[(2-methylpropan-2-yl)oxy]silane;zirconium (PubChem CID 18689460) has the molecular formula C6H16O2SiZr and a molecular weight of 239.50 g/mol. Its IUPAC name is hydroxy-dimethyl-[(2-methylpropan-2-yl)oxy]silane;zirconium.

Molecular Properties

Compound Namehydroxy-dimethyl-[(2-methylpropan-2-yl)oxy]silane;zirconium
PubChem CID18689460
Molecular FormulaC6H16O2SiZr
Molecular Weight239.50 g/mol
Exact Mass238.00
IUPAC Namehydroxy-dimethyl-[(2-methylpropan-2-yl)oxy]silane;zirconium
SMILESCC(C)(C)O[Si](C)(C)O.[Zr]
InChIInChI=1S/C6H16O2Si.Zr/c1-6(2,3)8-9(4,5)7;/h7H,1-5H3;
InChIKeyYLWXIKLJTGIDKJ-UHFFFAOYSA-N
XLogP1.49
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.50
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of hydroxy-dimethyl-[(2-methylpropan-2-yl)oxy]silane;zirconium?
The IUPAC name of hydroxy-dimethyl-[(2-methylpropan-2-yl)oxy]silane;zirconium (CID 18689460) is hydroxy-dimethyl-[(2-methylpropan-2-yl)oxy]silane;zirconium.
What is the SMILES notation for hydroxy-dimethyl-[(2-methylpropan-2-yl)oxy]silane;zirconium?
The canonical SMILES for hydroxy-dimethyl-[(2-methylpropan-2-yl)oxy]silane;zirconium is CC(C)(C)O[Si](C)(C)O.[Zr].
What is the InChIKey of hydroxy-dimethyl-[(2-methylpropan-2-yl)oxy]silane;zirconium?
The InChIKey is YLWXIKLJTGIDKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16O2Si.Zr/c1-6(2,3)8-9(4,5)7;/h7H,1-5H3;.
What are the key properties of hydroxy-dimethyl-[(2-methylpropan-2-yl)oxy]silane;zirconium?
hydroxy-dimethyl-[(2-methylpropan-2-yl)oxy]silane;zirconium has a molecular weight of 239.50 g/mol, XLogP of 1.49, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-dimethyl-[(2-methylpropan-2-yl)oxy]silane;zirconium is sourced from PubChem (CID 18689460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).