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Chloropentafluoroethane
CAS: 76-15-3 | C2ClF5
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
76-15-3
Molecular Formula:
C2ClF5
Molecular Weight:
154.46500000000003 g/mol
Names and Synonyms:
Chloropentafluoroethane
Refrigerant R115
FKW 115
CFC 115
Pentafluoroethyl chloride
1-Chloropentafluoroethane
Perfluoroethyl chloride
Monochloropentafluoroethane
Fluorocarbon 115
Propellant 115
FC 115
Pentafluorochloroethane
Chloroperfluoroethane
R 115
Genetron 115
Freon 115
F 115
1-Chloro-1,1,2,2,2-pentafluoroethane
Ethane, chloropentafluoro-
Ethane, 1-chloro-1,1,2,2,2-pentafluoro-
Identifiers:
SMILES:
FC(F)(F)C(F)(F)Cl
InChI:
InChI=1S/C2ClF5/c3-1(4,5)2(6,7)8
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
| Category | Property | Value | Source |
|---|---|---|---|
| Physical Properties | molecular_mass | 154.47 g/mol | Legacy Database |
| density | 1.30 g/cm³ | Legacy Database | |
| wikipedia_url | https://en.wikipedia.org/wiki/Chloropentafluoroethane | Legacy Database | |
| cas-boiling-point | -37.7 °C @ Press: 760 Torr | Legacy Database | |
| cas-canonical-smile | FC(F)(F)C(F)(F)Cl | Legacy Database | |
| cas-density | 1.3 g/cm3 | Legacy Database | |
| cas-inchi | InChI=1S/C2ClF5/c3-1(4,5)2(6,7)8 | Legacy Database | |
| cas-inchi-key | InChIKey=RFCAUADVODFSLZ-UHFFFAOYSA-N | Legacy Database | |
| cas-melting-point | -106 °C | Legacy Database | |
| cas-name | 1-Chloro-1,1,2,2,2-pentafluoroethane | Legacy Database | |
| wikipedia-name | Chloropentafluoroethane | Legacy Database | |
| LogP | 2.3803 | RDKit | |
| Molecular | Molecular Weight | 154.46500000000003 g/mol | RDKit |
| Exact | Exact Molecular Weight | 153.96086878 g/mol | RDKit |
| Heavy | Heavy Atom Count | 8 count | RDKit |
| Hydrogen | Hydrogen Bond Acceptors | 0 count | RDKit |
| Hydrogen Bond Donors | 0 count | RDKit | |
| Rotatable | Rotatable Bonds | 0 count | RDKit |
| Aromatic | Aromatic Ring Count | 0 count | RDKit |
| Topological | Topological Polar Surface Area | 0.0 Ų | RDKit |
| Molar | Molar Refractivity | 16.855 | RDKit |
