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Molecule
2,2,4-Trimethyl-1-Oxa-4-Aza-2-Silacyclohexane
CAS: 10196-49-3 · C6H15NOSi
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 10196-49-3
- Molecular Formula
- C6H15NOSi
- Molecular Mass
- 145.28 g/mol
Identifiers
CAS Registry Number
10196-49-3
SMILES
CN1CCO[Si](C)(C)C1
InChI Key
GGPLWEZGITVTJX-UHFFFAOYSA-N
InChI
InChI=1S/C6H15NOSi/c1-7-4-5-8-9(2,3)6-7/h4-6H2,1-3H3
Names and Synonyms
- 2,2,4-Trimethyl-1-Oxa-4-Aza-2-Silacyclohexane Systematic Name
- 1-Oxa-4-aza-2-silacyclohexane, 2,2,4-trimethyl- Synonym
- 2,2,4-Trimethyl-1-oxa-4-aza-2-silacyclohexane Synonym
- 2,2,4-Trimethyl-2-silamorpholine Synonym
- 2,2,4-Trimethyl-1,4,2-oxazasilinane Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 145.28 g/mol | CAS Common Chemistry |
| 145.278 g/mol | RDKit | |
| Canonical SMILES | O1CCN(C)C[Si]1(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C6H15NOSi/c1-7-4-5-8-9(2,3)6-7/h4-6H2,1-3H3 | CAS Common Chemistry |
| InChI Key | InChIKey=GGPLWEZGITVTJX-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | 2,2,4-Trimethyl-1-oxa-4-aza-2-silacyclohexane | CAS Common Chemistry |
| Heavy Atom Count | 9 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 12.47 Ų | RDKit |
| 12.24 Ų | chempirical lib | |
| LogP | 0.6926999999999999 | RDKit |
| 0.6927 | RDKit | |
| Molar Refractivity | 40.93100000000001 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 145.09229063 g/mol | RDKit |
| Boiling Point | 28 °C @ 1 Torr | CAS Common Chemistry |
Spectral Data
NMR, IR, and Mass spectral data
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
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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.
External Resources
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MW = 145.28 g/mol. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C6H15NOSi.
