CID 157162871

H2B2O2 — CID 157162871

IUPAC—
SMILESO[B]O.[B]
InChIInChI=1S/BH2O2.B/c2-1-3;/h2-3H;
InChIKeyXEFXQRYQZDKZOQ-UHFFFAOYSA-N
MW55.64 g/mol
LogP-1.88
Rot. Bonds

About CID 157162871

CID 157162871 (PubChem CID 157162871) has the molecular formula H2B2O2 and a molecular weight of 55.64 g/mol.

Molecular Properties

Compound NameCID 157162871
PubChem CID157162871
Molecular FormulaH2B2O2
Molecular Weight55.64 g/mol
Exact Mass56.02
IUPAC Name—
SMILESO[B]O.[B]
InChIInChI=1S/BH2O2.B/c2-1-3;/h2-3H;
InChIKeyXEFXQRYQZDKZOQ-UHFFFAOYSA-N
XLogP-1.88
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50055.64
LogP ≤ 5-1.88
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 157162871?
The IUPAC name of CID 157162871 (CID 157162871) is not available.
What is the SMILES notation for CID 157162871?
The canonical SMILES for CID 157162871 is O[B]O.[B].
What is the InChIKey of CID 157162871?
The InChIKey is XEFXQRYQZDKZOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/BH2O2.B/c2-1-3;/h2-3H;.
What are the key properties of CID 157162871?
CID 157162871 has a molecular weight of 55.64 g/mol, XLogP of -1.88, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 157162871 is sourced from PubChem (CID 157162871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).