CID 161453856

BFeNdY — CID 161453856

IUPAC—
SMILES[B].[Fe].[Nd].[Y]
InChIInChI=1S/B.Fe.Nd.Y
InChIKeyWAWRNRIRNRAEFE-UHFFFAOYSA-N
MW299.80 g/mol
LogP-0.39
Rot. Bonds

About CID 161453856

CID 161453856 (PubChem CID 161453856) has the molecular formula BFeNdY and a molecular weight of 299.80 g/mol.

Molecular Properties

Compound NameCID 161453856
PubChem CID161453856
Molecular FormulaBFeNdY
Molecular Weight299.80 g/mol
Exact Mass297.76
IUPAC Name—
SMILES[B].[Fe].[Nd].[Y]
InChIInChI=1S/B.Fe.Nd.Y
InChIKeyWAWRNRIRNRAEFE-UHFFFAOYSA-N
XLogP-0.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.80
LogP ≤ 5-0.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 161453856?
The IUPAC name of CID 161453856 (CID 161453856) is not available.
What is the SMILES notation for CID 161453856?
The canonical SMILES for CID 161453856 is [B].[Fe].[Nd].[Y].
What is the InChIKey of CID 161453856?
The InChIKey is WAWRNRIRNRAEFE-UHFFFAOYSA-N. The full InChI is InChI=1S/B.Fe.Nd.Y.
What are the key properties of CID 161453856?
CID 161453856 has a molecular weight of 299.80 g/mol, XLogP of -0.39, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 161453856 is sourced from PubChem (CID 161453856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).