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1-Chloro-1,2,2,2-Tetrafluoroethane
CAS: 2837-89-0 | C2HClF4
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
2837-89-0
Molecular Formula:
C2HClF4
Molecular Weight:
136.475 g/mol
Names and Synonyms:
1-Chloro-1,2,2,2-Tetrafluoroethane
F 124 (halocarbon)
Khladon 124
F 124
Fron 124
CFC 124
HCFC 124
1,1,1,2-Tetrafluoro-2-chloroethane
FC 124
1,1,1,2-Tetrafluorochloroethane
R 124
1-Chloro-1,2,2,2-tetrafluoroethane
Freon 124
2-Chloro-1,1,1,2-tetrafluoroethane
Ethane, 2-chloro-1,1,1,2-tetrafluoro-
Identifiers:
SMILES:
FC(Cl)C(F)(F)F
InChI:
InChI=1S/C2HClF4/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 |
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200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
Shift (ppm) | DEPT | Assignment |
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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 | 136.48 g/mol | Legacy Database |
density | 1.36 g/cm³ | Legacy Database |
wikipedia_url | https://en.wikipedia.org/wiki/1-Chloro-1,2,2,2-tetrafluoroethane None | Legacy Database |
cas-boiling-point | -12 °C None | Legacy Database |
cas-canonical-smile | FC(Cl)C(F)(F)F None | Legacy Database |
cas-density | 1.364 g/cm3 @ Temp: 25 °C None | Legacy Database |
cas-inchi | InChI=1S/C2HClF4/c3-1(4)2(5,6)7/h1H None | Legacy Database |
cas-inchi-key | InChIKey=BOUGCJDAQLKBQH-UHFFFAOYSA-N None | Legacy Database |
cas-melting-point | -199 °C None | Legacy Database |
cas-name | HCFC 124 None | Legacy Database |
wikipedia-name | 1-Chloro-1,2,2,2-tetrafluoroethane None | Legacy Database |
LogP | 2.0831 | RDKit |
Molecular
Property | Value | Source |
---|---|---|
Molecular Weight | 136.475 g/mol | RDKit |
Exact
Property | Value | Source |
---|---|---|
Exact Molecular Weight | 135.970290592 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 |
Molar
Property | Value | Source |
---|---|---|
Molar Refractivity | 16.804000000000002 | RDKit |