tetraphenylboranuide tetrafluoroborate

C24H20B2F4-2 — CID 87564099

IUPACtetraphenylboranuide tetrafluoroborate
SMILESF[B-](F)(F)F.c1ccc([B-](c2ccccc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C24H20B.BF4/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;2-1(3,4)5/h1-20H;/q2*-1
InChIKeyMDGVFSIZYYFQBN-UHFFFAOYSA-N
MW406.04 g/mol
LogP4.36
Rot. Bonds4

About tetraphenylboranuide tetrafluoroborate

tetraphenylboranuide tetrafluoroborate (PubChem CID 87564099) has the molecular formula C24H20B2F4-2 and a molecular weight of 406.04 g/mol. Its IUPAC name is tetraphenylboranuide tetrafluoroborate.

Molecular Properties

Compound Nametetraphenylboranuide tetrafluoroborate
PubChem CID87564099
Molecular FormulaC24H20B2F4-2
Molecular Weight406.04 g/mol
Exact Mass406.17
IUPAC Nametetraphenylboranuide tetrafluoroborate
SMILESF[B-](F)(F)F.c1ccc([B-](c2ccccc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C24H20B.BF4/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;2-1(3,4)5/h1-20H;/q2*-1
InChIKeyMDGVFSIZYYFQBN-UHFFFAOYSA-N
XLogP4.36
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.04
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

Sodium Tetraphenylborate
CID 2723787
Triphenylborane
CID 70400
Tetraphenyltin
CID 61146
Tetraphenyllead
CID 72906
Tetraphenylantimony Bromide
CID 88914
Tetraphenylborate
CID 8934
Tetraphenylgermane
CID 66103
Diphenylborinic anhydride
CID 596810
Borate(1-), tetraphenyl-, lithium (1:1)
CID 23668466
Stibine, 1,1'-oxybis(1,1-diphenyl-
CID 16683975
Ammonium tetraphenylborate
CID 14496924
Potassium tetraphenylborate
CID 23665558

Frequently Asked Questions

What is the IUPAC name of tetraphenylboranuide tetrafluoroborate?
The IUPAC name of tetraphenylboranuide tetrafluoroborate (CID 87564099) is tetraphenylboranuide tetrafluoroborate.
What is the SMILES notation for tetraphenylboranuide tetrafluoroborate?
The canonical SMILES for tetraphenylboranuide tetrafluoroborate is F[B-](F)(F)F.c1ccc([B-](c2ccccc2)(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of tetraphenylboranuide tetrafluoroborate?
The InChIKey is MDGVFSIZYYFQBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20B.BF4/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;2-1(3,4)5/h1-20H;/q2*-1.
What are the key properties of tetraphenylboranuide tetrafluoroborate?
tetraphenylboranuide tetrafluoroborate has a molecular weight of 406.04 g/mol, XLogP of 4.36, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tetraphenylboranuide tetrafluoroborate is sourced from PubChem (CID 87564099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).