tetrakis(3-fluorophenyl)boranuide

C24H16BF4- — CID 10169188

IUPACtetrakis(3-fluorophenyl)boranuide
SMILESFc1cccc([B-](c2cccc(F)c2)(c2cccc(F)c2)c2cccc(F)c2)c1
InChIInChI=1S/C24H16BF4/c26-21-9-1-5-17(13-21)25(18-6-2-10-22(27)14-18,19-7-3-11-23(28)15-19)20-8-4-12-24(29)16-20/h1-16H/q-1
InChIKeyFRRYCRQLTCYVSH-UHFFFAOYSA-N
MW391.20 g/mol
LogP3.62
Rot. Bonds4

About tetrakis(3-fluorophenyl)boranuide

tetrakis(3-fluorophenyl)boranuide (PubChem CID 10169188) has the molecular formula C24H16BF4- and a molecular weight of 391.20 g/mol. Its IUPAC name is tetrakis(3-fluorophenyl)boranuide.

Molecular Properties

Compound Nametetrakis(3-fluorophenyl)boranuide
PubChem CID10169188
Molecular FormulaC24H16BF4-
Molecular Weight391.20 g/mol
Exact Mass391.13
IUPAC Nametetrakis(3-fluorophenyl)boranuide
SMILESFc1cccc([B-](c2cccc(F)c2)(c2cccc(F)c2)c2cccc(F)c2)c1
InChIInChI=1S/C24H16BF4/c26-21-9-1-5-17(13-21)25(18-6-2-10-22(27)14-18,19-7-3-11-23(28)15-19)20-8-4-12-24(29)16-20/h1-16H/q-1
InChIKeyFRRYCRQLTCYVSH-UHFFFAOYSA-N
XLogP3.62
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.20
LogP ≤ 53.62
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 tetrakis(3-fluorophenyl)boranuide?
The IUPAC name of tetrakis(3-fluorophenyl)boranuide (CID 10169188) is tetrakis(3-fluorophenyl)boranuide.
What is the SMILES notation for tetrakis(3-fluorophenyl)boranuide?
The canonical SMILES for tetrakis(3-fluorophenyl)boranuide is Fc1cccc([B-](c2cccc(F)c2)(c2cccc(F)c2)c2cccc(F)c2)c1.
What is the InChIKey of tetrakis(3-fluorophenyl)boranuide?
The InChIKey is FRRYCRQLTCYVSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16BF4/c26-21-9-1-5-17(13-21)25(18-6-2-10-22(27)14-18,19-7-3-11-23(28)15-19)20-8-4-12-24(29)16-20/h1-16H/q-1.
What are the key properties of tetrakis(3-fluorophenyl)boranuide?
tetrakis(3-fluorophenyl)boranuide has a molecular weight of 391.20 g/mol, XLogP of 3.62, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis(3-fluorophenyl)boranuide is sourced from PubChem (CID 10169188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).