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1,1′-(Difluorosilylene)Bis[Benzene]
CAS: 312-40-3 | C12H10F2Si
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
312-40-3
Molecular Formula:
C12H10F2Si
Molecular Mass:
220.29 g/mol
Names and Synonyms:
1,1′-(Difluorosilylene)Bis[Benzene]
Benzene, 1,1′-(difluorosilylene)bis-
Silane, difluorodiphenyl-
1,1′-(Difluorosilylene)bis[benzene]
Diphenyldifluorosilane
Difluorodiphenylsilane
Diphenylsilane difluoride
NSC 136542
Identifiers:
SMILES:
F[Si](F)(c1ccccc1)c1ccccc1
InChI:
InChI=1S/C12H10F2Si/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H
Key Properties
Boiling Point
156 °C @ Press: 50 Torr
CAS Common Chemistry
Density
1.15 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 | 220.29 g/mol | CAS Common Chemistry |
| 220.294 g/mol | RDKit | |
| 220.05198329 g/mol | RDKit | |
| Density | 1.15 g/cm³ | CAS Common Chemistry |
| 1.145 g/cm3 @ Temp: 17 °C | CAS Common Chemistry | |
| Boiling Point | 156 °C @ Press: 50 Torr | CAS Common Chemistry |
| Canonical SMILES | F[Si](F)(C=1C=CC=CC1)C=2C=CC=CC2 | CAS Common Chemistry |
| InChI | InChI=1S/C12H10F2Si/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H | CAS Common Chemistry |
| InChI Key | InChIKey=BOMPXIHODLVNMC-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | 1,1′-(Difluorosilylene)bis[benzene] | CAS Common Chemistry |
| Heavy Atom Count | 15 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | 2.1820000000000004 | RDKit |
| Molar Refractivity | 60.122000000000035 | RDKit |
