CID 156621432

HB2LiO — CID 156621432

IUPAC—
SMILES[B][B-]O.[Li+]
InChIInChI=1S/B2HO.Li/c1-2-3;/h3H;/q-1;+1
InChIKeyRACLXFULXONJGF-UHFFFAOYSA-N
MW45.57 g/mol
LogP-4.31
Rot. Bonds

About CID 156621432

CID 156621432 (PubChem CID 156621432) has the molecular formula HB2LiO and a molecular weight of 45.57 g/mol.

Molecular Properties

Compound NameCID 156621432
PubChem CID156621432
Molecular FormulaHB2LiO
Molecular Weight45.57 g/mol
Exact Mass46.04
IUPAC Name—
SMILES[B][B-]O.[Li+]
InChIInChI=1S/B2HO.Li/c1-2-3;/h3H;/q-1;+1
InChIKeyRACLXFULXONJGF-UHFFFAOYSA-N
XLogP-4.31
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50045.57
LogP ≤ 5-4.31
H-Bond Donors ≤ 51
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 156621432?
The IUPAC name of CID 156621432 (CID 156621432) is not available.
What is the SMILES notation for CID 156621432?
The canonical SMILES for CID 156621432 is [B][B-]O.[Li+].
What is the InChIKey of CID 156621432?
The InChIKey is RACLXFULXONJGF-UHFFFAOYSA-N. The full InChI is InChI=1S/B2HO.Li/c1-2-3;/h3H;/q-1;+1.
What are the key properties of CID 156621432?
CID 156621432 has a molecular weight of 45.57 g/mol, XLogP of -4.31, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 156621432 is sourced from PubChem (CID 156621432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).