bis(difluoroboranyl)-fluoroborane

B3F5 — CID 23234061

IUPACbis(difluoroboranyl)-fluoroborane
SMILESFB(F)B(F)B(F)F
InChIInChI=1S/B3F5/c4-1(2(5)6)3(7)8
InChIKeyUNGYJMVQLBNDLP-UHFFFAOYSA-N
MW127.43 g/mol
LogP0.96
Rot. Bonds2

About bis(difluoroboranyl)-fluoroborane

bis(difluoroboranyl)-fluoroborane (PubChem CID 23234061) has the molecular formula B3F5 and a molecular weight of 127.43 g/mol. Its IUPAC name is bis(difluoroboranyl)-fluoroborane.

Molecular Properties

Compound Namebis(difluoroboranyl)-fluoroborane
PubChem CID23234061
Molecular FormulaB3F5
Molecular Weight127.43 g/mol
Exact Mass128.02
IUPAC Namebis(difluoroboranyl)-fluoroborane
SMILESFB(F)B(F)B(F)F
InChIInChI=1S/B3F5/c4-1(2(5)6)3(7)8
InChIKeyUNGYJMVQLBNDLP-UHFFFAOYSA-N
XLogP0.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.43
LogP ≤ 50.96
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 bis(difluoroboranyl)-fluoroborane?
The IUPAC name of bis(difluoroboranyl)-fluoroborane (CID 23234061) is bis(difluoroboranyl)-fluoroborane.
What is the SMILES notation for bis(difluoroboranyl)-fluoroborane?
The canonical SMILES for bis(difluoroboranyl)-fluoroborane is FB(F)B(F)B(F)F.
What is the InChIKey of bis(difluoroboranyl)-fluoroborane?
The InChIKey is UNGYJMVQLBNDLP-UHFFFAOYSA-N. The full InChI is InChI=1S/B3F5/c4-1(2(5)6)3(7)8.
What are the key properties of bis(difluoroboranyl)-fluoroborane?
bis(difluoroboranyl)-fluoroborane has a molecular weight of 127.43 g/mol, XLogP of 0.96, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(difluoroboranyl)-fluoroborane is sourced from PubChem (CID 23234061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).