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Chloro(Methyl)Diphenylsilane
CAS: 144-79-6 | C13H13ClSi
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
144-79-6
Molecular Formula:
C13H13ClSi
Molecular Mass:
232.79 g/mol
Names and Synonyms:
Chloro(Methyl)Diphenylsilane
Benzene, 1,1′-(chloromethylsilylene)bis-
Silane, chloromethyldiphenyl-
1,1′-(Chloromethylsilylene)bis[benzene]
Diphenyl(methyl)chlorosilane
Methyldiphenylchlorosilane
Chloro(methyl)diphenylsilane
Methyldiphenylsilyl chloride
Chlorodiphenylmethylsilane
TSL 8066
Diphenyl(methyl)silyl chloride
NSC 93961
Identifiers:
SMILES:
C[Si](Cl)(c1ccccc1)c1ccccc1
InChI:
InChI=1S/C13H13ClSi/c1-15(14,12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11H,1H3
Key Properties
Boiling Point
295 °C
CAS Common Chemistry
Melting Point
-22 °C
CAS Common Chemistry
Density
1.13 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 | 232.79 g/mol | CAS Common Chemistry |
| 232.78600000000003 g/mol | RDKit | |
| 232.047504626 g/mol | RDKit | |
| Density | 1.13 g/cm³ | CAS Common Chemistry |
| 1.128 g/cm3 | CAS Common Chemistry | |
| Boiling Point | 295 °C | CAS Common Chemistry |
| Canonical SMILES | Cl[Si](C=1C=CC=CC1)(C=2C=CC=CC2)C | CAS Common Chemistry |
| InChI | InChI=1S/C13H13ClSi/c1-15(14,12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11H,1H3 | CAS Common Chemistry |
| InChI Key | InChIKey=OJZNZOXALZKPEA-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | -22 °C | CAS Common Chemistry |
| Name | Chloro(methyl)diphenylsilane | 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 | 2.6149000000000004 | RDKit |
| Molar Refractivity | 69.62300000000003 | RDKit |
