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Molecule
1,2-Dichlorotetrafluoroethane
CAS: 76-14-2 · C2Cl2F4
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 76-14-2
- Molecular Formula
- C2Cl2F4
- Molecular Mass
- 170.92 g/mol
Identifiers
CAS Registry Number
76-14-2
SMILES
FC(F)(Cl)C(F)(F)Cl
InChI Key
DDMOUSALMHHKOS-UHFFFAOYSA-N
InChI
InChI=1S/C2Cl2F4/c3-1(5,6)2(4,7)8
Names and Synonyms
- 1,2-Dichlorotetrafluoroethane Systematic Name
- Ethane, 1,2-dichloro-1,1,2,2-tetrafluoro- Synonym
- Ethane, 1,2-dichlorotetrafluoro- Synonym
- 1,2-Dichloro-1,1,2,2-tetrafluoroethane Synonym
- F 114 (halocarbon) Synonym
- Ucon 114 Synonym
- Arcton 33 Synonym
- Cryofluorane Synonym
- sym-Dichlorotetrafluoroethane Synonym
- 1,2-Dichlorotetrafluoroethane Synonym
- Frigen 114 Synonym
- Genetron 114 Synonym
- 1,1,2,2-Tetrafluoro-1,2-dichloroethane Synonym
- Freon 114 Synonym
- Ledon 114 Synonym
- 1,2-Dichloroperfluoroethane Synonym
- Fluorocarbon 114 Synonym
- R 114 (halocarbon) Synonym
- FC 114 Synonym
- Propellant 114 Synonym
- Frigiderm Synonym
- Genetron 316 Synonym
- Cryofluoran Synonym
- Arcton 114 Synonym
- Refrigerant 114 Synonym
- CFC 114 Synonym
- F 114 Synonym
- FKW 114 Synonym
- Fron 114 Synonym
- R 114 Synonym
- Dichloro-1,1,2,2-tetrafluoroethane Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 170.92 g/mol | CAS Common Chemistry |
| 170.92000000000002 g/mol | RDKit | |
| 170.914 g/mol | chempirical lib | |
| Density | 1.46 g/cm³ | CAS Common Chemistry |
| 1.455 g/cm3 @ 25 °C | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/1,2-Dichlorotetrafluoroethane | CAS Common Chemistry |
| Canonical SMILES | FC(F)(Cl)C(F)(F)Cl | CAS Common Chemistry |
| InChI | InChI=1S/C2Cl2F4/c3-1(5,6)2(4,7)8 | CAS Common Chemistry |
| InChI Key | InChIKey=DDMOUSALMHHKOS-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | -94 °C | CAS Common Chemistry |
| Name | CFC 114 | CAS Common Chemistry |
| 1,2-Dichlorotetrafluoroethane | CAS Common Chemistry | |
| Heavy Atom Count | 8 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 1 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | 2.6495999999999995 | RDKit |
| 2.6496 | RDKit | |
| Molar Refractivity | 21.6 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 169.93131824 g/mol | RDKit |
| Boiling Point | 3.8 °C @ 760 Torr | CAS Common Chemistry |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
8
7
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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.
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MW = 170.92 g/mol; density = 1.460 g/mL. Edit any field — others recompute live.
