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Molecule
Dichlorodiphenylsilane
CAS: 80-10-4 · C12H10Cl2Si
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 80-10-4
- Molecular Formula
- C12H10Cl2Si
- Molecular Mass
- 253.20 g/mol
Identifiers
CAS Registry Number
80-10-4
SMILES
Cl[Si](Cl)(c1ccccc1)c1ccccc1
InChI Key
OSXYHAQZDCICNX-UHFFFAOYSA-N
InChI
InChI=1S/C12H10Cl2Si/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H
Names and Synonyms
- Dichlorodiphenylsilane Common Name
- Benzene, 1,1′-(dichlorosilylene)bis- Synonym
- Silane, dichlorodiphenyl- Synonym
- 1,1′-(Dichlorosilylene)bis[benzene] Synonym
- Dichlorodiphenylsilane Synonym
- Diphenyldichlorosilane Synonym
- Diphenylsilicon dichloride Synonym
- Diphenylsilyl dichloride Synonym
- TSL 8062 Synonym
- NSC 77110 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Melting Point | -22 °C | CAS Common Chemistry |
| Molecular Mass | 253.20 g/mol | CAS Common Chemistry |
| 253.20400000000004 g/mol | RDKit | |
| 253.204 g/mol | RDKit | |
| 253.198 g/mol | chempirical lib | |
| Density | 1.20 g/cm³ | CAS Common Chemistry |
| 1.204 g/cm3 @ 25 °C | CAS Common Chemistry | |
| Boiling Point | 305 °C | CAS Common Chemistry |
| Canonical SMILES | Cl[Si](Cl)(C=1C=CC=CC1)C=2C=CC=CC2 | CAS Common Chemistry |
| InChI | InChI=1S/C12H10Cl2Si/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=OSXYHAQZDCICNX-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Dichlorodiphenylsilane | 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 | 2.720600000000001 | RDKit |
| 2.7206 | RDKit | |
| Molar Refractivity | 69.61200000000002 cm³/mol | RDKit |
| Ring Count | 2 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 251.99288221 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
8
7
6
5
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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 = 253.20 g/mol; density = 1.200 g/mL. Edit any field — others recompute live.
