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Molecule
Nitrogen Trifluoride
CAS: 7783-54-2 · F3N
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 7783-54-2
- Molecular Formula
- F3N
- Molecular Mass
- 71.00 g/mol
Identifiers
CAS Registry Number
7783-54-2
SMILES
FN(F)F
InChI Key
GVGCUCJTUSOZKP-UHFFFAOYSA-N
InChI
InChI=1S/F3N/c1-4(2)3
Names and Synonyms
- Nitrogen Trifluoride Common Name
- Nitrogen fluoride (NF3) Synonym
- Nitrogen trifluoride Synonym
- Perfluoroammonia Synonym
- Trifluoroammonia Synonym
- Trifluoroamine Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 71.00 g/mol | CAS Common Chemistry |
| 71.001 g/mol | RDKit | |
| Density | 1.92 g/cm³ | CAS Common Chemistry |
| 1.92 g/cm3 @ -216.7 °C | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Nitrogen_trifluoride | CAS Common Chemistry |
| Boiling Point | -129 °C | CAS Common Chemistry |
| Canonical SMILES | FN(F)F | CAS Common Chemistry |
| InChI | InChI=1S/F3N/c1-4(2)3 | CAS Common Chemistry |
| InChI Key | InChIKey=GVGCUCJTUSOZKP-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | -208.5 °C | CAS Common Chemistry |
| Name | Nitrogen trifluoride | CAS Common Chemistry |
| Heavy Atom Count | 4 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 3.24 Ų | RDKit |
| 3.01 Ų | chempirical lib | |
| LogP | 0.9419000000000001 | RDKit |
| 0.9419 | RDKit | |
| Molar Refractivity | 5.163 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 70.99828366 g/mol | RDKit |
Spectral Data
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.
External Resources
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Quick conversion
MW = 71.00 g/mol; density = 1.920 g/mL. Edit any field — others recompute live.
