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Molecule
Isobutyltriethoxysilane
CAS: 17980-47-1 · C10H24O3Si
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 17980-47-1
- Molecular Formula
- C10H24O3Si
- Molecular Mass
- 220.39 g/mol
Identifiers
CAS Registry Number
17980-47-1
SMILES
CCO[Si](CC(C)C)(OCC)OCC
InChI Key
ALVYUZIFSCKIFP-UHFFFAOYSA-N
InChI
InChI=1S/C10H24O3Si/c1-6-11-14(12-7-2,13-8-3)9-10(4)5/h10H,6-9H2,1-5H3
Names and Synonyms
- Isobutyltriethoxysilane Synonym
- Silane, triethoxy(2-methylpropyl)- Synonym
- Silane, triethoxyisobutyl- Synonym
- Triethoxy(2-methylpropyl)silane Synonym
- Isobutyltriethoxysilane Synonym
- Dynasylan BSM 100N Synonym
- Dynasylan BSM 40N Synonym
- Dynasylan IBTEO Synonym
- Z 6403 Synonym
- Triethoxyisobutylsilane Synonym
- Sicong SP 205 Synonym
- Xiameter OFS 6403 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 220.39 g/mol | CAS Common Chemistry |
| 220.38499999999993 g/mol | RDKit | |
| 220.385 g/mol | RDKit | |
| Density | 0.91 g/cm³ | CAS Common Chemistry |
| 0.910 g/cm3 | CAS Common Chemistry | |
| Boiling Point | 190-191 °C | CAS Common Chemistry |
| Canonical SMILES | O(CC)[Si](OCC)(OCC)CC(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C10H24O3Si/c1-6-11-14(12-7-2,13-8-3)9-10(4)5/h10H,6-9H2,1-5H3 | CAS Common Chemistry |
| InChI Key | InChIKey=ALVYUZIFSCKIFP-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Isobutyltriethoxysilane | CAS Common Chemistry |
| Heavy Atom Count | 14 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 8 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 27.69 Ų | RDKit |
| LogP | 2.690800000000001 | RDKit |
| 2.6908 | RDKit | |
| Molar Refractivity | 60.27700000000005 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 220.14947115799998 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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1
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| Shift (ppm) | Multiplicity | Integration | Assignment |
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200 ppm
180
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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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Quick conversion
MW = 220.39 g/mol; density = 0.910 g/mL. Edit any field — others recompute live.
