CID 23695096

BCeCl3Na — CID 23695096

IUPAC—
SMILESCl[Ce](Cl)Cl.[B-].[Na+]
InChIInChI=1S/B.Ce.3ClH.Na/h;;3*1H;/q-1;+3;;;;+1/p-3
InChIKeyCIPHNMDLDSRUEP-UHFFFAOYSA-K
MW280.28 g/mol
LogP-1.31
Rot. Bonds

About CID 23695096

CID 23695096 (PubChem CID 23695096) has the molecular formula BCeCl3Na and a molecular weight of 280.28 g/mol.

Molecular Properties

Compound NameCID 23695096
PubChem CID23695096
Molecular FormulaBCeCl3Na
Molecular Weight280.28 g/mol
Exact Mass278.81
IUPAC Name—
SMILESCl[Ce](Cl)Cl.[B-].[Na+]
InChIInChI=1S/B.Ce.3ClH.Na/h;;3*1H;/q-1;+3;;;;+1/p-3
InChIKeyCIPHNMDLDSRUEP-UHFFFAOYSA-K
XLogP-1.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.28
LogP ≤ 5-1.31
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 23695096?
The IUPAC name of CID 23695096 (CID 23695096) is not available.
What is the SMILES notation for CID 23695096?
The canonical SMILES for CID 23695096 is Cl[Ce](Cl)Cl.[B-].[Na+].
What is the InChIKey of CID 23695096?
The InChIKey is CIPHNMDLDSRUEP-UHFFFAOYSA-K. The full InChI is InChI=1S/B.Ce.3ClH.Na/h;;3*1H;/q-1;+3;;;;+1/p-3.
What are the key properties of CID 23695096?
CID 23695096 has a molecular weight of 280.28 g/mol, XLogP of -1.31, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 23695096 is sourced from PubChem (CID 23695096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).