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Molecule
Perfluorohexylethyl Acrylate
CAS: 17527-29-6 · C11H7F13O2
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 17527-29-6
- Molecular Formula
- C11H7F13O2
- Molecular Mass
- 418.15 g/mol
Identifiers
CAS Registry Number
17527-29-6
SMILES
C=CC(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChI Key
VPKQPPJQTZJZDB-UHFFFAOYSA-N
InChI
InChI=1S/C11H7F13O2/c1-2-5(25)26-4-3-6(12,13)7(14,15)8(16,17)9(18,19)10(20,21)11(22,23)24/h2H,1,3-4H2
Names and Synonyms
- Perfluorohexylethyl Acrylate Synonym
- 2-Propenoic acid, 3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl ester Synonym
- Acrylic acid, 3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl ester Synonym
- 2-(Perfluorohexyl)ethyl acrylate Synonym
- Fluowet AC 600 Synonym
- R 1620 Synonym
- Perfluorohexylethyl acrylate Synonym
- 3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluorooctyl acrylate Synonym
- FAAC 6 Synonym
- Cheminox FAAC 6 Synonym
- 1H,1H,2H,2H-Perfluorooctyl acrylate Synonym
- Actyflon G 06C Synonym
- 3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluorooctyl prop-2-enoate Synonym
- Viscoat 13F Synonym
- 3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluorooctanyl acrylate Synonym
- PFAC 6 Synonym
- 1H,2H,2H-Perfluorooctyl acrylate Synonym
- 1H,1H,2H,2H-Tridecafluorooctyl acrylate Synonym
- C 6SFA Synonym
- AC 600 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 418.15 g/mol | CAS Common Chemistry |
| 418.14899999999994 g/mol | RDKit | |
| 418.149 g/mol | RDKit | |
| Canonical SMILES | O=C(OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C=C | CAS Common Chemistry |
| InChI | InChI=1S/C11H7F13O2/c1-2-5(25)26-4-3-6(12,13)7(14,15)8(16,17)9(18,19)10(20,21)11(22,23)24/h2H,1,3-4H2 | CAS Common Chemistry |
| InChI Key | InChIKey=VPKQPPJQTZJZDB-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Perfluorohexylethyl acrylate | CAS Common Chemistry |
| Heavy Atom Count | 26 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 8 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 26.3 Ų | RDKit |
| LogP | 4.844500000000001 | RDKit |
| 4.8445 | RDKit | |
| Molar Refractivity | 56.562999999999995 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.7273 | RDKit |
| 0.73 | chempirical lib | |
| Exact Mass | 418.02384632400003 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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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.
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MW = 418.15 g/mol. Edit any field — others recompute live.
