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Pentafluoroethane
CAS: 354-33-6 | C2HF5
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
354-33-6
Molecular Formula:
C2HF5
Molecular Weight:
120.02000000000001 g/mol
Names and Synonyms:
Pentafluoroethane
Ethane, 1,1,1,2,2-pentafluoro-
Ethane, pentafluoro-
1,1,1,2,2-Pentafluoroethane
Pentafluoroethane
R 125
HFC 125
1,1,2,2,2-Pentafluoroethane
F 125
FC 125
Fron 125
HCFC 125
Ecolo Ace 125
Khladon 125
HFA 125
Freon 125
HFO 125
Identifiers:
SMILES:
FC(F)C(F)(F)F
InChI:
InChI=1S/C2HF5/c3-1(4)2(5,6)7/h1H
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
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 120.02000000000001 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 119.999841132 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 7 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 |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | 1.8137999999999999 | RDKit |
| molecular_mass | 120.02 g/mol | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Pentafluoroethane None | Legacy Database |
| cas-boiling-point | -48.5 °C None | Legacy Database |
| cas-canonical-smile | FC(F)C(F)(F)F None | Legacy Database |
| cas-inchi | InChI=1S/C2HF5/c3-1(4)2(5,6)7/h1H None | Legacy Database |
| cas-inchi-key | InChIKey=GTLACDSXYULKMZ-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | -103 °C None | Legacy Database |
| cas-name | Pentafluoroethane None | Legacy Database |
| wikipedia-name | Pentafluoroethane None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 12.059000000000001 | RDKit |
