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Molecule
2,3,3,3-Tetrafluoropropene
CAS: 754-12-1 · C3H2F4
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 754-12-1
- Molecular Formula
- C3H2F4
- Molecular Mass
- 114.04 g/mol
Identifiers
CAS Registry Number
754-12-1
SMILES
C=C(F)C(F)(F)F
InChI Key
FXRLMCRCYDHQFW-UHFFFAOYSA-N
InChI
InChI=1S/C3H2F4/c1-2(4)3(5,6)7/h1H2
Names and Synonyms
- 2,3,3,3-Tetrafluoropropene Systematic Name
- 1-Propene, 2,3,3,3-tetrafluoro- Synonym
- Propene, 2,3,3,3-tetrafluoro- Synonym
- 2,3,3,3-Tetrafluoro-1-propene Synonym
- 2,3,3,3-Tetrafluoropropene Synonym
- 1,1,1,2-Tetrafluoro-2-propene Synonym
- HFO 1234yf Synonym
- HFC 1234yf Synonym
- HFC 1134yf Synonym
- R 1234yf Synonym
- 1234yf Synonym
- 1,1,1,2-Tetrafluoropropene Synonym
- 2,3,3,3-Tetrafluoropropylene Synonym
- Solstice 1234yf Synonym
- HFC 1234fy Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 114.04 g/mol | CAS Common Chemistry |
| 114.04100000000001 g/mol | RDKit | |
| 114.041 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 |
| 2.21 | chempirical lib | |
| Molar Refractivity | 16.303 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.3333 | RDKit |
| 0.33 | chempirical lib | |
| Exact Mass | 114.009262944 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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1
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| Shift (ppm) | Multiplicity | Integration | Assignment |
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200 ppm
180
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| 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.
External Resources
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MW = 114.04 g/mol. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C3H2F4.
