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Molecule
Tempo
CAS: 2564-83-2 · C9H18NO
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 2564-83-2
- Molecular Formula
- C9H18NO
- Molecular Mass
- 156.25 g/mol
Identifiers
CAS Registry Number
2564-83-2
SMILES
CC1(C)CCCC(C)(C)N1[O]
InChI Key
QYTDEUPAUMOIOP-UHFFFAOYSA-N
InChI
InChI=1S/C9H18NO/c1-8(2)6-5-7-9(3,4)10(8)11/h5-7H2,1-4H3
Names and Synonyms
- Tempo Synonym
- 1-Piperidinyloxy, 2,2,6,6-tetramethyl- Synonym
- Piperidinooxy, 2,2,6,6-tetramethyl- Synonym
- 2,2,6,6-Tetramethyl-1-piperidinyloxy Synonym
- 1,1,5,5-Tetramethylpentamethylene nitroxide Synonym
- 2,2,6,6-Tetramethylpiperidinooxy Synonym
- 2,2,6,6-Tetramethylpiperidine-1-oxyl Synonym
- 2,2,6,6-Tetramethylpiperidine N-oxyl Synonym
- 2,2,6,6-Tetramethylpiperidin-1-oxy Synonym
- 2,2,6,6-Tetramethylpiperidinooxy radical Synonym
- 2,2,6,6-Tetramethylpiperidinoxyl radical Synonym
- Tanane Synonym
- Tanan Synonym
- 2,2,6,6-Tetramethylpiperidine N-oxide radical Synonym
- 2,2,6,6-Tetramethylpiperidine N-oxyl radical Synonym
- 2,2,6,6-Tetramethylpiperidinoxyl Synonym
- 2,2,6,6-Tetramethyl-1-piperadoxyl Synonym
- 2,2,6,6-Tetramethylpiperidoxyl Synonym
- 2,2,6,6-Tetramethylpiperidinyloxy Synonym
- 2,2,6,6-Tetramethylpiperidinyl-N-oxy Synonym
- 1-Oxyl-2,2,6,6-tetramethylpiperidine Synonym
- 2,2,6,6-Tetramethyl-1-piperidinoxyl Synonym
- 2,2,6,6-Tetramethyl-1-oxylpiperidine Synonym
- 2,2,6,6-Tetramethylpiperidinooxyl Synonym
- 2,2,6,6-Tetramethylpiperidinyl-1-oxyl Synonym
- 2,2,6,6-Tetramethylpiperidine nitroxide Synonym
- 2,2,6,6-Tetramethyl-1-piperidyloxy Synonym
- 2,2,6,6-Tetramethylpiperidine nitroxide radical Synonym
- Tempo Synonym
- 2,2,6,6-Tetramethylpiperidinyl 1-oxide Synonym
- 2,2,6,6-Tetramethylpiperidin-1-oxyl radical Synonym
- HO 6 Synonym
- 2,2,6,6-Tetramethylpiperidino-1-oxy Synonym
- 2,2,6,6-Tetramethylpiperidin-N-oxyl Synonym
- 2,2,6,6-Tetramethylpiperidine N-oxy Synonym
- 2,2,6,6-Tetramethylpiperidine N-oxide Synonym
- 2,2,6,6-Tetramethylpiperidine oxide Synonym
- TMPO Synonym
- 2,2,6,6-Tetramethyl-1-piperidine-N-oxyl Synonym
- 2,2,6,6-Tetramethylpiperidinoxy Synonym
- T 3751 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 156.25 g/mol | CAS Common Chemistry |
| 156.249 g/mol | RDKit | |
| 157.257 g/mol | chempirical lib | |
| Wikipedia Url | https://en.wikipedia.org/wiki/TEMPO | CAS Common Chemistry |
| Canonical SMILES | [O]N1C(C)(C)CCCC1(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C9H18NO/c1-8(2)6-5-7-9(3,4)10(8)11/h5-7H2,1-4H3 | CAS Common Chemistry |
| InChI Key | InChIKey=QYTDEUPAUMOIOP-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 35 °C | CAS Common Chemistry |
| Name | Tempo | CAS Common Chemistry |
| TEMPO | CAS Common Chemistry | |
| Heavy Atom Count | 11 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 23.14 Ų | RDKit |
| 23.24 Ų | chempirical lib | |
| LogP | 2.375000000000001 | RDKit |
| 2.375 | RDKit | |
| Molar Refractivity | 44.534500000000016 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 156.138839196 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
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100
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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.
External Resources
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MW = 156.25 g/mol. Edit any field — others recompute live.