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1,1′-(Ethoxymethylsilylene)Bis[Benzene]
CAS: 1825-59-8 | C15H18OSi
2D Structure
3D Structure
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Basic Information
CAS Registry Number:
1825-59-8
Molecular Formula:
C15H18OSi
Molecular Mass:
242.39 g/mol
Names and Synonyms:
1,1′-(Ethoxymethylsilylene)Bis[Benzene]
Benzene, 1,1′-(ethoxymethylsilylene)bis-
Silane, ethoxymethyldiphenyl-
1,1′-(Ethoxymethylsilylene)bis[benzene]
Methyldiphenylethoxysilane
Ethoxymethyldiphenylsilane
Diphenylmethylethoxysilane
Identifiers:
SMILES:
CCO[Si](C)(c1ccccc1)c1ccccc1
InChI:
InChI=1S/C15H18OSi/c1-3-16-17(2,14-10-6-4-7-11-14)15-12-8-5-9-13-15/h4-13H,3H2,1-2H3
Key Properties
Boiling Point
100-102 °C @ Press: 0.3 Torr
CAS Common Chemistry
Melting Point
-27 °C
CAS Common Chemistry
Density
1.02 g/cm³
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
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.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 242.39 g/mol | CAS Common Chemistry |
| 242.394 g/mol | RDKit | |
| 242.11269172599998 g/mol | RDKit | |
| Density | 1.02 g/cm³ | CAS Common Chemistry |
| 1.018 g/cm3 | CAS Common Chemistry | |
| Boiling Point | 100-102 °C @ Press: 0.3 Torr | CAS Common Chemistry |
| Canonical SMILES | O(CC)[Si](C=1C=CC=CC1)(C=2C=CC=CC2)C | CAS Common Chemistry |
| InChI | InChI=1S/C15H18OSi/c1-3-16-17(2,14-10-6-4-7-11-14)15-12-8-5-9-13-15/h4-13H,3H2,1-2H3 | CAS Common Chemistry |
| InChI Key | InChIKey=ADLWTVQIBZEAGJ-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | -27 °C | CAS Common Chemistry |
| Name | 1,1′-(Ethoxymethylsilylene)bis[benzene] | CAS Common Chemistry |
| Heavy Atom Count | 17 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 4 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 9.23 Ų | RDKit |
| LogP | 2.4126000000000003 | RDKit |
| Molar Refractivity | 75.39600000000004 | RDKit |
