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Tetraethylammonium Perchlorate
CAS: 2567-83-1 | C8H20ClNO4
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
2567-83-1
Molecular Formula:
C8H20ClNO4
Molecular Mass:
229.70 g/mol
Names and Synonyms:
Tetraethylammonium Perchlorate
Ethanaminium, N,N,N-triethyl-, perchlorate (1:1)
Ammonium, tetraethyl-, perchlorate
Tetraethylammonium perchlorate
Ethanaminium, N,N,N-triethyl-, perchlorate
NSC 220061
TEAP
Identifiers:
SMILES:
CC[N+](CC)(CC)CC.[O-][Cl+3]([O-])([O-])[O-]
InChI:
InChI=1S/C8H20N.ClHO4/c1-5-9(6-2,7-3)8-4;2-1(3,4)5/h5-8H2,1-4H3;(H,2,3,4,5)/q+1;/p-1
Key Properties
Melting Point
>300 °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 | 229.70 g/mol | CAS Common Chemistry |
| 229.70399999999998 g/mol | RDKit | |
| 229.1080858 g/mol | RDKit | |
| Canonical SMILES | O=Cl(=O)(=O)[O-].CC[N+](CC)(CC)CC | CAS Common Chemistry |
| InChI | InChI=1S/C8H20N.ClHO4/c1-5-9(6-2,7-3)8-4;2-1(3,4)5/h5-8H2,1-4H3;(H,2,3,4,5)/q+1;/p-1 | CAS Common Chemistry |
| InChI Key | InChIKey=WGHUNMFFLAMBJD-UHFFFAOYSA-M | CAS Common Chemistry |
| Melting Point | >300 °C | CAS Common Chemistry |
| Name | Tetraethylammonium perchlorate | CAS Common Chemistry |
| Heavy Atom Count | 14 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 4 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 92.24 Ų | RDKit |
| LogP | -2.8731999999999953 | RDKit |
| Molar Refractivity | 42.424400000000006 | RDKit |
