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Benzyldimethylsilane
CAS: 1631-70-5 | C9H14Si
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
1631-70-5
Molecular Formula:
C9H14Si
Molecular Weight:
150.297 g/mol
Names and Synonyms:
Benzyldimethylsilane
Silane, benzyldimethyl-
Dimethylbenzylsilane
Benzyldimethylsilane
Benzyldimethylhydrosilane
[(Dimethylsilyl)methyl]benzene
Silane, dimethyl(phenylmethyl)-
Benzene, [(dimethylsilyl)methyl]-
NSC 155373
Identifiers:
SMILES:
C[SiH](C)Cc1ccccc1
InChI:
InChI=1S/C9H14Si/c1-10(2)8-9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3
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
| Category | Property | Value | Source |
|---|---|---|---|
| Physical Properties | molecular_mass | 150.30 g/mol | Legacy Database |
| density | 0.95 g/cm³ | Legacy Database | |
| cas-name | Benzyldimethylsilane | Legacy Database | |
| cas-boiling-point | 70 °C @ Press: 15 Torr | Legacy Database | |
| cas-canonical-smile | C=1C=CC(=CC1)C[SiH](C)C | Legacy Database | |
| cas-density | 0.949 g/cm3 | Legacy Database | |
| cas-inchi | InChI=1S/C9H14Si/c1-10(2)8-9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3 | Legacy Database | |
| cas-inchi-key | InChIKey=USQQZWZBVGCDBX-UHFFFAOYSA-N | Legacy Database | |
| LogP | 2.255 | RDKit | |
| Molecular | Molecular Weight | 150.297 g/mol | RDKit |
| Exact | Exact Molecular Weight | 150.086476978 g/mol | RDKit |
| Heavy | Heavy Atom Count | 10 count | RDKit |
| Hydrogen | Hydrogen Bond Acceptors | 0 count | RDKit |
| Hydrogen Bond Donors | 0 count | RDKit | |
| Rotatable | Rotatable Bonds | 2 count | RDKit |
| Aromatic | Aromatic Ring Count | 1 count | RDKit |
| Topological | Topological Polar Surface Area | 0.0 Ų | RDKit |
| Molar | Molar Refractivity | 49.02300000000003 | RDKit |
