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2,3,3,3-Tetrafluoropropene
CAS: 754-12-1 | C3H2F4
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
754-12-1
Molecular Formula:
C3H2F4
Molecular Mass:
114.04 g/mol
Names and Synonyms:
2,3,3,3-Tetrafluoropropene
1-Propene, 2,3,3,3-tetrafluoro-
Propene, 2,3,3,3-tetrafluoro-
2,3,3,3-Tetrafluoro-1-propene
2,3,3,3-Tetrafluoropropene
1,1,1,2-Tetrafluoro-2-propene
HFO 1234yf
HFC 1234yf
HFC 1134yf
R 1234yf
1234yf
1,1,1,2-Tetrafluoropropene
2,3,3,3-Tetrafluoropropylene
Solstice 1234yf
HFC 1234fy
Identifiers:
SMILES:
C=C(F)C(F)(F)F
InChI:
InChI=1S/C3H2F4/c1-2(4)3(5,6)7/h1H2
Key Properties
Boiling Point
-28.3 °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 | 114.04 g/mol | CAS Common Chemistry |
| 114.04100000000001 g/mol | RDKit | |
| 114.009262944 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/2,3,3,3-Tetrafluoropropene | CAS Common Chemistry |
| Boiling Point | -28.3 °C | CAS Common Chemistry |
| Canonical SMILES | FC(=C)C(F)(F)F | CAS Common Chemistry |
| InChI | InChI=1S/C3H2F4/c1-2(4)3(5,6)7/h1H2 | CAS Common Chemistry |
| InChI Key | InChIKey=FXRLMCRCYDHQFW-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | 2,3,3,3-Tetrafluoropropene | CAS Common Chemistry |
| Heavy Atom Count | 7 | 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 | 2.0319 | RDKit |
| Molar Refractivity | 16.303 | RDKit |
