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Perfluorohexylethyl Acrylate
CAS: 17527-29-6 | C11H7F13O2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
17527-29-6
Molecular Formula:
C11H7F13O2
Molecular Mass:
418.15 g/mol
Names and Synonyms:
Perfluorohexylethyl Acrylate
2-Propenoic acid, 3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl ester
Acrylic acid, 3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl ester
2-(Perfluorohexyl)ethyl acrylate
Fluowet AC 600
R 1620
Perfluorohexylethyl acrylate
3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluorooctyl acrylate
FAAC 6
Cheminox FAAC 6
1H,1H,2H,2H-Perfluorooctyl acrylate
Actyflon G 06C
3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluorooctyl prop-2-enoate
Viscoat 13F
3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluorooctanyl acrylate
PFAC 6
1H,2H,2H-Perfluorooctyl acrylate
1H,1H,2H,2H-Tridecafluorooctyl acrylate
C 6SFA
AC 600
Identifiers:
SMILES:
C=CC(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
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
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 | 418.15 g/mol | CAS Common Chemistry |
| 418.14899999999994 g/mol | RDKit | |
| 418.02384632400003 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 |
| Molar Refractivity | 56.562999999999995 | RDKit |
