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Phosphorus Pentafluoride
CAS: 7647-19-0 | F5P
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
7647-19-0
Molecular Formula:
F5P
Molecular Mass:
125.96 g/mol
Names and Synonyms:
Phosphorus Pentafluoride
Phosphorane, pentafluoro-
Phosphorus fluoride (PF5)
Pentafluorophosphorane
Phosphorus pentafluoride
Pentafluorophosphorus
Identifiers:
SMILES:
FP(F)(F)(F)F
InChI:
InChI=1S/F5P/c1-6(2,3,4)5
Key Properties
Boiling Point
-84.6 °C
CAS Common Chemistry
Melting Point
-93.8 °C
CAS Common Chemistry
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
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 125.96 g/mol | CAS Common Chemistry |
| 125.96400000000001 g/mol | RDKit | |
| 125.96577773 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Phosphorus_pentafluoride | CAS Common Chemistry |
| Boiling Point | -84.6 °C | CAS Common Chemistry |
| Canonical SMILES | FP(F)(F)(F)F | CAS Common Chemistry |
| InChI | InChI=1S/F5P/c1-6(2,3,4)5 | CAS Common Chemistry |
| InChI Key | InChIKey=OBCUTHMOOONNBS-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | -93.8 °C | CAS Common Chemistry |
| Name | Pentafluorophosphorane | CAS Common Chemistry |
| Phosphorus pentafluoride | CAS Common Chemistry | |
| Heavy Atom Count | 6 | 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 Ų | RDKit |
| LogP | 2.9621999999999997 | RDKit |
| Molar Refractivity | 12.460000000000003 | RDKit |
