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Tetramethylammonium Perchlorate
CAS: 2537-36-2 | C4H12ClNO4
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
2537-36-2
Molecular Formula:
C4H12ClNO4
Molecular Mass:
173.60 g/mol
Names and Synonyms:
Tetramethylammonium Perchlorate
Methanaminium, N,N,N-trimethyl-, perchlorate (1:1)
Ammonium, tetramethyl-, perchlorate
Methanaminium, N,N,N-trimethyl-, perchlorate
Tetramethylammonium perchlorate
NSC 245090
Identifiers:
SMILES:
C[N+](C)(C)C.[O-][Cl+3]([O-])([O-])[O-]
InChI:
InChI=1S/C4H12N.ClHO4/c1-5(2,3)4;2-1(3,4)5/h1-4H3;(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 | 173.60 g/mol | CAS Common Chemistry |
| 173.59599999999998 g/mol | RDKit | |
| 173.045485544 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Tetramethylammonium_perchlorate | CAS Common Chemistry |
| Canonical SMILES | O=Cl(=O)(=O)[O-].C[N+](C)(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C4H12N.ClHO4/c1-5(2,3)4;2-1(3,4)5/h1-4H3;(H,2,3,4,5)/q+1;/p-1 | CAS Common Chemistry |
| InChI Key | InChIKey=ZCWKIFAQRXNZCH-UHFFFAOYSA-M | CAS Common Chemistry |
| Melting Point | 300 °C | CAS Common Chemistry |
| Name | Tetramethylammonium perchlorate | CAS Common Chemistry |
| Heavy Atom Count | 10 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 92.24 Ų | RDKit |
| LogP | -4.4335999999999975 | RDKit |
| Molar Refractivity | 23.95639999999999 | RDKit |
