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Molecule
N-[(Triethoxysilyl)Methyl]Cyclohexanamine
CAS: 26495-91-0 · C13H29NO3Si
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 26495-91-0
- Molecular Formula
- C13H29NO3Si
- Molecular Mass
- 275.47 g/mol
Identifiers
CAS Registry Number
26495-91-0
SMILES
CCO[Si](CNC1CCCCC1)(OCC)OCC
InChI Key
WUFHQGLVNNOXMP-UHFFFAOYSA-N
InChI
InChI=1S/C13H29NO3Si/c1-4-15-18(16-5-2,17-6-3)12-14-13-10-8-7-9-11-13/h13-14H,4-12H2,1-3H3
Names and Synonyms
- N-[(Triethoxysilyl)Methyl]Cyclohexanamine Synonym
- Cyclohexanamine, N-[(triethoxysilyl)methyl]- Synonym
- Cyclohexylamine, N-[(triethoxysilyl)methyl]- Synonym
- N-[(Triethoxysilyl)methyl]cyclohexanamine Synonym
- N-Cyclohexyl(aminomethyl)triethoxysilane Synonym
- [(Cyclohexylamino)methyl]triethoxysilane Synonym
- N-[(Triethoxysilyl)methyl]cyclohexylamine Synonym
- Geniosil XL 926 Synonym
- SIC 2464.2 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 275.47 g/mol | CAS Common Chemistry |
| 275.465 g/mol | RDKit | |
| Density | 0.95 g/cm³ | CAS Common Chemistry |
| 0.95 g/cm3 | CAS Common Chemistry | |
| Boiling Point | 236 °C | CAS Common Chemistry |
| Canonical SMILES | O(CC)[Si](OCC)(OCC)CNC1CCCCC1 | CAS Common Chemistry |
| InChI | InChI=1S/C13H29NO3Si/c1-4-15-18(16-5-2,17-6-3)12-14-13-10-8-7-9-11-13/h13-14H,4-12H2,1-3H3 | CAS Common Chemistry |
| InChI Key | InChIKey=WUFHQGLVNNOXMP-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | N-[(Triethoxysilyl)methyl]cyclohexanamine | CAS Common Chemistry |
| Heavy Atom Count | 18 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 9 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 39.72 Ų | RDKit |
| LogP | 2.4963000000000006 | RDKit |
| 2.4963 | RDKit | |
| Molar Refractivity | 75.50770000000006 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 275.19167031800004 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
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40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
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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 = 275.47 g/mol; density = 0.950 g/mL. Edit any field — others recompute live.
