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Perfluorotriethylamine
CAS: 359-70-6 | C6F15N
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
359-70-6
Molecular Formula:
C6F15N
Molecular Mass:
371.04 g/mol
Names and Synonyms:
Perfluorotriethylamine
Ethanamine, 1,1,2,2,2-pentafluoro-N,N-bis(1,1,2,2,2-pentafluoroethyl)-
Triethylamine, pentadecafluoro-
Ethanamine, 1,1,2,2,2-pentafluoro-N,N-bis(pentafluoroethyl)-
1,1,2,2,2-Pentafluoro-N,N-bis(1,1,2,2,2-pentafluoroethyl)ethanamine
Perfluorotriethylamine
Pentadecafluorotriethylamine
Tri(perfluoroethyl)amine
Tris(pentafluoroethyl)amine
Tris(perfluoroethyl) amine
FC 131 (amine)
FC 131
Identifiers:
SMILES:
FC(F)(F)C(F)(F)N(C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)F
InChI:
InChI=1S/C6F15N/c7-1(8,9)4(16,17)22(5(18,19)2(10,11)12)6(20,21)3(13,14)15
Key Properties
Boiling Point
71 °C
CAS Common Chemistry
Melting Point
-110 °C
CAS Common Chemistry
Density
1.74 g/cm³
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 | 371.04 g/mol | CAS Common Chemistry |
| 371.04299999999995 g/mol | RDKit | |
| 370.9791223 g/mol | RDKit | |
| Density | 1.74 g/cm³ | CAS Common Chemistry |
| 1.736 g/cm3 @ Temp: 25 °C | CAS Common Chemistry | |
| Boiling Point | 71 °C | CAS Common Chemistry |
| Canonical SMILES | FC(F)(F)C(F)(F)N(C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)F | CAS Common Chemistry |
| InChI | InChI=1S/C6F15N/c7-1(8,9)4(16,17)22(5(18,19)2(10,11)12)6(20,21)3(13,14)15 | CAS Common Chemistry |
| InChI Key | InChIKey=CBEFDCMSEZEGCX-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | -110 °C | CAS Common Chemistry |
| Name | Perfluorotriethylamine | CAS Common Chemistry |
| Heavy Atom Count | 22 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 3 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 3.24 Ų | RDKit |
| LogP | 4.7537 | RDKit |
| Molar Refractivity | 34.84499999999999 | RDKit |
