potassium tetraphenylboranuide

C24H20BK — CID 23665558

IUPACpotassium tetraphenylboranuide
SMILES[K+].c1ccc([B-](c2ccccc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C24H20B.K/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;/h1-20H;/q-1;+1
InChIKeyMAMCUZQNCMYPCY-UHFFFAOYSA-N
MW358.33 g/mol
LogP0.07
Rot. Bonds4

About potassium tetraphenylboranuide

potassium tetraphenylboranuide (PubChem CID 23665558) has the molecular formula C24H20BK and a molecular weight of 358.33 g/mol. Its IUPAC name is potassium tetraphenylboranuide.

Molecular Properties

Compound Namepotassium tetraphenylboranuide
PubChem CID23665558
Molecular FormulaC24H20BK
Molecular Weight358.33 g/mol
Exact Mass358.13
IUPAC Namepotassium tetraphenylboranuide
SMILES[K+].c1ccc([B-](c2ccccc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C24H20B.K/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;/h1-20H;/q-1;+1
InChIKeyMAMCUZQNCMYPCY-UHFFFAOYSA-N
XLogP0.07
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.33
LogP ≤ 50.07
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 potassium tetraphenylboranuide?
The IUPAC name of potassium tetraphenylboranuide (CID 23665558) is potassium tetraphenylboranuide.
What is the SMILES notation for potassium tetraphenylboranuide?
The canonical SMILES for potassium tetraphenylboranuide is [K+].c1ccc([B-](c2ccccc2)(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of potassium tetraphenylboranuide?
The InChIKey is MAMCUZQNCMYPCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20B.K/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;/h1-20H;/q-1;+1.
What are the key properties of potassium tetraphenylboranuide?
potassium tetraphenylboranuide has a molecular weight of 358.33 g/mol, XLogP of 0.07, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for potassium tetraphenylboranuide is sourced from PubChem (CID 23665558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).