CID 158651326

OSiTiZr — CID 158651326

IUPAC—
SMILESO=[Si].[Ti].[Zr]
InChIInChI=1S/OSi.Ti.Zr/c1-2;;
InChIKeyIBPBQSJLAYPVTL-UHFFFAOYSA-N
MW183.18 g/mol
LogP-0.50
Rot. Bonds

About CID 158651326

CID 158651326 (PubChem CID 158651326) has the molecular formula OSiTiZr and a molecular weight of 183.18 g/mol.

Molecular Properties

Compound NameCID 158651326
PubChem CID158651326
Molecular FormulaOSiTiZr
Molecular Weight183.18 g/mol
Exact Mass181.82
IUPAC Name—
SMILESO=[Si].[Ti].[Zr]
InChIInChI=1S/OSi.Ti.Zr/c1-2;;
InChIKeyIBPBQSJLAYPVTL-UHFFFAOYSA-N
XLogP-0.50
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.18
LogP ≤ 5-0.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 CID 158651326?
The IUPAC name of CID 158651326 (CID 158651326) is not available.
What is the SMILES notation for CID 158651326?
The canonical SMILES for CID 158651326 is O=[Si].[Ti].[Zr].
What is the InChIKey of CID 158651326?
The InChIKey is IBPBQSJLAYPVTL-UHFFFAOYSA-N. The full InChI is InChI=1S/OSi.Ti.Zr/c1-2;;.
What are the key properties of CID 158651326?
CID 158651326 has a molecular weight of 183.18 g/mol, XLogP of -0.50, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 158651326 is sourced from PubChem (CID 158651326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).