CAS 14635-75-7|Nitrosonium tetrafluoroborate 98%|nitrosonium tetrafluoroborate|Nitrosyl tetrafluoroborate|iminooxidanium; tetrafluoroboranuide|Nitrosyl tetrafluoroborate|Nitrosonium tetrafluoroborat...

General Information

Structure

Molecular Formula

BF₄NO

Molecular Mass

116.8107128

Exact Mass

117.00090691

Charge

InChI

InChI=1S/BF4.NO/c2-1(3,4)5;1-2/q-1;+1

InChIKey

KGCNVGDHOSFKFT-UHFFFAOYSA-N

Canonic Smiles

F[B-](F)(F)F.[O+]#N

Isomeric Smiles

N#[O+].[B-](F)(F)(F)F

Calculated Properties

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

-1.13

LogD (pH = 7.4)

-1.13

Log P

-1.13

Molar Refractivity

6.0052

Polarizability

3.1085358

Polar Surface Area

0.0

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Academic Data

Commercial Catalog

Data Source

Names and Identifiers

Synonyms

Nitrosonium tetrafluoroborate 98%Nitrosyl tetrafluoroborateNitrosyl tetrafluoroborateNitrosonium tetrafluoroborate四氟硼酸亚硝鎓四氟硼酸亚硝亚硝四氟硼酸盐Nitrosonium tetrafluoroborate

IUPAC Traditional name

nitrosonium tetrafluoroborate

IUPAC name

iminooxidanium; tetrafluoroboranuide

Names and Identifiers

Registration numbers

MDL Number

MFCD00011433

CAS Number

14635-75-7

PubChem SID

2485036024886632162084753

EC Number

238-679-2

PubChem CID

11137142

Merck Index

146649

Registration numbers

Properties

Physical Property

Density

2.185

Melting Point

250(subl.)°C

250°C subl.

Boiling Point

250°C/0.01mm subl.

Properties

Related Proteins

No Data Available

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Molecular Spectra

No Data Available

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Molecule Details

Sigma Aldrich

175064

Packaging
5, 25, 50 g in amber poly

Apollo Scientific

PC5290

Versatile crystalline nitrosating agent. Converts arylamines to aryl fluorides via diazonium tetrafluoroborates: Chem. Ber., 88, 1939 (1995).. in Teflon bottles

Molecule Details

References

PubChem Literature

From Data Sources

• Convenient catalyst for iodination of aromatics by iodide ion with air as oxidant: J. Org. Chem., 53, 3548 (1988), or for addition of iodine (or iodine + nucleophile) to alkenes: Acta Chem. Scand. B, 43, 902 (1989).

• With excess reagent, oxidation of the isoxazoline to the isoxazole occurs.

• Crystalline nitrosating agent: Secondary amines to nitrosamines: Chem. Ber., 89, 2374 (1956); deamination of primary amides: J. Org. Chem., 30, 2386 (1965); conversion of arylhydrazines to azides: Tetrahedron Lett., 28, 5091 (1987). In organic solvents, converts arylamines directly to diazonium tetrafluoroborates which undergo the Balz-Schiemann reaction (see Tetrafluoroboric acid, L14037) in situ to give high yields of aryl fluorides: Chem. Ber., 88, 1939 (1955); EP 430,434 (1991). Methyl or methoxy substituted aromatics in acetonitrile give the nitrosoaromatics in good yield: J. Org. Chem., 59, 5573 (1994).

• Undergoes an interesting insertion reaction with diarylcyclopropanes: Chem. Lett., 233 (1988):

References

Bioactivity

PubChem BioAssay

Bioactivity

Data Source

Academic Data

Commercial Catalog

Names and Identifiers

Synonyms

IUPAC Traditional name

nitrosonium tetrafluoroborate

IUPAC name

iminooxidanium; tetrafluoroboranuide

Registration numbers

MDL Number

MFCD00011433

CAS Number

14635-75-7

PubChem SID

2485036024886632162084753

EC Number

238-679-2

PubChem CID

11137142

Merck Index

146649

Properties

Physical Property

Density

2.185

Melting Point

250(subl.)°C

250°C subl.

Boiling Point

250°C/0.01mm subl.

Molecule Details

Sigma Aldrich

175064

Packaging
5, 25, 50 g in amber poly

Apollo Scientific

PC5290

Versatile crystalline nitrosating agent. Converts arylamines to aryl fluorides via diazonium tetrafluoroborates: Chem. Ber., 88, 1939 (1995).. in Teflon bottles

References

PubChem Literature

From Data Sources

• With excess reagent, oxidation of the isoxazoline to the isoxazole occurs.

• Undergoes an interesting insertion reaction with diarylcyclopropanes: Chem. Lett., 233 (1988):

Bioactivity

PubChem BioAssay

Molecule

ID:98307