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Molecule
Decyltrimethoxysilane
CAS: 5575-48-4 · C13H30O3Si
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 5575-48-4
- Molecular Formula
- C13H30O3Si
- Molecular Mass
- 262.47 g/mol
Identifiers
CAS Registry Number
5575-48-4
SMILES
CCCCCCCCCC[Si](OC)(OC)OC
InChI Key
KQAHMVLQCSALSX-UHFFFAOYSA-N
InChI
InChI=1S/C13H30O3Si/c1-5-6-7-8-9-10-11-12-13-17(14-2,15-3)16-4/h5-13H2,1-4H3
Names and Synonyms
- Decyltrimethoxysilane Synonym
- KBM 8103 Synonym
- Silane, decyltrimethoxy- Synonym
- Trimethoxydecylsilane Synonym
- Decyltrimethoxysilane Synonym
- KBM 3103C Synonym
- KBM 310C Synonym
- n-Decyltrimethoxysilane Synonym
- AY 43-210MC Synonym
- KBM 3103 Synonym
- Z 6210 Synonym
- LS 5258 Synonym
- KBM 3013C Synonym
- KBM 3013 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 262.47 g/mol | CAS Common Chemistry |
| 262.46599999999995 g/mol | RDKit | |
| 262.466 g/mol | RDKit | |
| Canonical SMILES | O(C)[Si](OC)(OC)CCCCCCCCCC | CAS Common Chemistry |
| InChI | InChI=1S/C13H30O3Si/c1-5-6-7-8-9-10-11-12-13-17(14-2,15-3)16-4/h5-13H2,1-4H3 | CAS Common Chemistry |
| InChI Key | InChIKey=KQAHMVLQCSALSX-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Decyltrimethoxysilane | CAS Common Chemistry |
| Heavy Atom Count | 17 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 12 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 27.69 Ų | RDKit |
| LogP | 4.005200000000003 | RDKit |
| 4.0052 | RDKit | |
| Molar Refractivity | 74.19800000000006 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 262.19642135000004 g/mol | RDKit |
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
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.
External Resources
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MW = 262.47 g/mol. Edit any field — others recompute live.
