Aluminium Fluoride

CAS: 7784-18-1 · AlF3

2D Structure

Loading 3D structure...

CAS Registry Number

7784-18-1

SMILES

[Al+3].[F-].[F-].[F-]

InChI Key

KLZUFWVZNOTSEM-UHFFFAOYSA-K

InChI

InChI=1S/Al.3FH/h;3*1H/q+3;;;/p-3

Comprehensive physical and chemical properties

Property	Value	Source
Molecular Mass	83.98 g/mol	CAS Common Chemistry
	83.97600000000001 g/mol	RDKit
	83.97674829 g/mol	RDKit
	90.024 g/mol	chempirical lib
Density	3.10 g/cm³	CAS Common Chemistry
	3.10 g/cm3	CAS Common Chemistry
Wikipedia Url	https://en.wikipedia.org/wiki/Aluminium_fluoride	CAS Common Chemistry
Boiling Point	1260 °C	CAS Common Chemistry
Canonical SMILES	F[Al](F)F	CAS Common Chemistry
InChI	InChI=1S/Al.3FH/h;3*1H/q+3;;;/p-3	CAS Common Chemistry
InChI Key	InChIKey=KLZUFWVZNOTSEM-UHFFFAOYSA-K	CAS Common Chemistry
Melting Point	1291 °C	CAS Common Chemistry
Name	Aluminum fluoride	CAS Common Chemistry
	Aluminium fluoride	CAS Common Chemistry
Heavy Atom Count	4	RDKit
Hydrogen Bond Acceptors	0	RDKit
Hydrogen Bond Donors	0	RDKit
Rotatable Bonds	0	RDKit
Aromatic Ring Count	0	RDKit
Topological Polar Surface Area	0.0 Å²	RDKit
LogP	-9.3688	RDKit
Molar Refractivity	5.754 cm³/mol	RDKit
Ring Count	0	RDKit
Formal Charge	0	RDKit
Fraction Csp3	0.0	RDKit
Exact Mass	83.976 g/mol	RDKit

NMR, IR, and Mass spectral data

Predicting NMR spectra...

10 ppm 9 8 7 6 5 4 3 2 1 0 ppm

Shift (ppm)	Multiplicity	Integration	Assignment

200 ppm 180 160 140 120 100 80 60 40 20 0 ppm

Shift (ppm)	DEPT	Assignment

Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.

Convert

MW = 83.98 g/mol; density = 3.100 g/mL. Edit any field — others recompute live.

Mass (g) Moles (mmol) Moles (mol) Volume (mL)