CID 173228502

H2BO2Ru — CID 173228502

IUPAC—
SMILESO[B]O.[Ru]
InChIInChI=1S/BH2O2.Ru/c2-1-3;/h2-3H;
InChIKeyDVYFAPVIUVAYSQ-UHFFFAOYSA-N
MW145.90 g/mol
LogP-1.50
Rot. Bonds

About CID 173228502

CID 173228502 (PubChem CID 173228502) has the molecular formula H2BO2Ru and a molecular weight of 145.90 g/mol.

Molecular Properties

Compound NameCID 173228502
PubChem CID173228502
Molecular FormulaH2BO2Ru
Molecular Weight145.90 g/mol
Exact Mass146.92
IUPAC Name—
SMILESO[B]O.[Ru]
InChIInChI=1S/BH2O2.Ru/c2-1-3;/h2-3H;
InChIKeyDVYFAPVIUVAYSQ-UHFFFAOYSA-N
XLogP-1.50
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.90
LogP ≤ 5-1.50
H-Bond Donors ≤ 52
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 CID 173228502?
The IUPAC name of CID 173228502 (CID 173228502) is not available.
What is the SMILES notation for CID 173228502?
The canonical SMILES for CID 173228502 is O[B]O.[Ru].
What is the InChIKey of CID 173228502?
The InChIKey is DVYFAPVIUVAYSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/BH2O2.Ru/c2-1-3;/h2-3H;.
What are the key properties of CID 173228502?
CID 173228502 has a molecular weight of 145.90 g/mol, XLogP of -1.50, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173228502 is sourced from PubChem (CID 173228502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).