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Molecule
Chlorodiphenylsilane
CAS: 1631-83-0 · C12H11ClSi
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 1631-83-0
- Molecular Formula
- C12H11ClSi
- Molecular Mass
- 218.76 g/mol
Identifiers
CAS Registry Number
1631-83-0
SMILES
Cl[SiH](c1ccccc1)c1ccccc1
InChI Key
VTMOWGGHUAZESJ-UHFFFAOYSA-N
InChI
InChI=1S/C12H11ClSi/c13-14(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,14H
Names and Synonyms
- Chlorodiphenylsilane Common Name
- Benzene, 1,1′-(chlorosilylene)bis- Synonym
- Silane, chlorodiphenyl- Synonym
- 1,1′-(Chlorosilylene)bis[benzene] Synonym
- Chlorodiphenylsilane Synonym
- Diphenylchlorosilane Synonym
- Diphenylsilyl chloride Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 218.76 g/mol | CAS Common Chemistry |
| 218.759 g/mol | RDKit | |
| 218.756 g/mol | chempirical lib | |
| Density | 1.12 g/cm³ | CAS Common Chemistry |
| 1.118 g/cm3 | CAS Common Chemistry | |
| Canonical SMILES | Cl[SiH](C=1C=CC=CC1)C=2C=CC=CC2 | CAS Common Chemistry |
| InChI | InChI=1S/C12H11ClSi/c13-14(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,14H | CAS Common Chemistry |
| InChI Key | InChIKey=VTMOWGGHUAZESJ-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Chlorodiphenylsilane | CAS Common Chemistry |
| Heavy Atom Count | 14 | 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 | 1.7633999999999999 | RDKit |
| 1.7634 | RDKit | |
| Molar Refractivity | 65.15400000000004 cm³/mol | RDKit |
| Ring Count | 2 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 218.031854562 g/mol | RDKit |
| Boiling Point | 143 °C @ 10 Torr | CAS Common Chemistry |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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8
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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 = 218.76 g/mol; density = 1.120 g/mL. Edit any field — others recompute live.
