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Molecule
2-(3,4-Epoxycyclohexyl)Ethyltriethoxysilane
CAS: 10217-34-2 · C14H28O4Si
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 10217-34-2
- Molecular Formula
- C14H28O4Si
- Molecular Mass
- 288.46 g/mol
Identifiers
CAS Registry Number
10217-34-2
SMILES
CCO[Si](CCC1CCC2OC2C1)(OCC)OCC
InChI Key
UDUKMRHNZZLJRB-UHFFFAOYSA-N
InChI
InChI=1S/C14H28O4Si/c1-4-15-19(16-5-2,17-6-3)10-9-12-7-8-13-14(11-12)18-13/h12-14H,4-11H2,1-3H3
Names and Synonyms
- 2-(3,4-Epoxycyclohexyl)Ethyltriethoxysilane Synonym
- 7-Oxabicyclo[4.1.0]heptane, 3-[2-(triethoxysilyl)ethyl]- Synonym
- Silane, triethoxy[2-(7-oxabicyclo[4.1.0]hept-3-yl)ethyl]- Synonym
- 7-Oxabicyclo[4.1.0]heptane, silane deriv. Synonym
- 3-[2-(Triethoxysilyl)ethyl]-7-oxabicyclo[4.1.0]heptane Synonym
- β-(3,4-Epoxycyclohexyl)ethyltriethoxysilane Synonym
- 2-(3,4-Epoxycyclohexyl)ethyltriethoxysilane Synonym
- 1,2-Epoxy-4-(2-triethoxysilylethyl)cyclohexane Synonym
- CoatOSil 1770 Synonym
- Silquest Wetlink 90 Synonym
- Y 11870 Synonym
- CoatOSil Y 11988 Synonym
- S 1770 VAN Synonym
- CoatOSil A 1770 Synonym
- ADD 107 Synonym
- KH 567 Synonym
- CG 0186 Synonym
- KH 1770 Synonym
- DB 1770 Synonym
- Wetlink 90 Synonym
- (2-(7-Oxabicyclo[4.1.0]heptan-3-yl)ethyl)triethoxysilane Synonym
- A 1861 Synonym
- TCI-T 3585 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 288.46 g/mol | CAS Common Chemistry |
| 288.46000000000004 g/mol | RDKit | |
| Density | 1.02 g/cm³ | CAS Common Chemistry |
| 1.015 g/cm3 | CAS Common Chemistry | |
| Canonical SMILES | O(CC)[Si](OCC)(OCC)CCC1CCC2OC2C1 | CAS Common Chemistry |
| InChI | InChI=1S/C14H28O4Si/c1-4-15-19(16-5-2,17-6-3)10-9-12-7-8-13-14(11-12)18-13/h12-14H,4-11H2,1-3H3 | CAS Common Chemistry |
| InChI Key | InChIKey=UDUKMRHNZZLJRB-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | 2-(3,4-Epoxycyclohexyl)ethyltriethoxysilane | CAS Common Chemistry |
| Heavy Atom Count | 19 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 9 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 40.22 Ų | RDKit |
| 36.92 Ų | chempirical lib | |
| LogP | 2.9924000000000017 | RDKit |
| 2.9924 | RDKit | |
| Molar Refractivity | 76.05800000000006 cm³/mol | RDKit |
| Ring Count | 2 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 288.175685906 g/mol | RDKit |
| Boiling Point | 114-117 °C @ 0.4 Torr | CAS Common Chemistry |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
8
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5
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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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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.
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MW = 288.46 g/mol; density = 1.020 g/mL. Edit any field — others recompute live.
