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Phosphorus Trifluoride
CAS: 7783-55-3 | F3P
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
7783-55-3
Molecular Formula:
F3P
Molecular Weight:
87.968 g/mol
Names and Synonyms:
Phosphorus Trifluoride
Common Name
Trifluorophosphine
Synonym
Phosphorus trifluoride
Synonym
Phosphorus fluoride (PF3)
Synonym
Phosphorous trifluoride
Synonym
Identifiers:
SMILES:
FP(F)F
InChI:
InChI=1S/F3P/c1-4(2)3
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
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.
All Properties
Comprehensive physical and chemical properties
Physical Properties
| Property | Value | Source |
|---|---|---|
| molecular_mass | 87.97 g/mol | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Phosphorus_trifluoride None | Legacy Database |
| cas-boiling-point | -95 °C None | Legacy Database |
| cas-canonical-smile | FP(F)F None | Legacy Database |
| cas-inchi | InChI=1S/F3P/c1-4(2)3 None | Legacy Database |
| cas-inchi-key | InChIKey=WKFBZNUBXWCCHG-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | -160 °C None | Legacy Database |
| cas-name | Phosphorus trifluoride None | Legacy Database |
| wikipedia-name | Phosphorus trifluoride None | Legacy Database |
| LogP | 2.1218 | RDKit |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 87.968 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 87.96897129 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 4 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 0 count | RDKit |
| Hydrogen Bond Donors | 0 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 0 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 0.0 Ų | RDKit |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 10.244000000000002 | RDKit |