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Molecule
Benzyldimethylsilane
CAS: 1631-70-5 · C9H14Si
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 1631-70-5
- Molecular Formula
- C9H14Si
- Molecular Mass
- 150.30 g/mol
Identifiers
CAS Registry Number
1631-70-5
SMILES
C[SiH](C)Cc1ccccc1
InChI Key
USQQZWZBVGCDBX-UHFFFAOYSA-N
InChI
InChI=1S/C9H14Si/c1-10(2)8-9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3
Names and Synonyms
- Benzyldimethylsilane Common Name
- Benzene, [(dimethylsilyl)methyl]- Synonym
- Silane, benzyldimethyl- Synonym
- Silane, dimethyl(phenylmethyl)- Synonym
- [(Dimethylsilyl)methyl]benzene Synonym
- Benzyldimethylsilane Synonym
- Benzyldimethylhydrosilane Synonym
- NSC 155373 Synonym
- Dimethylbenzylsilane Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 150.30 g/mol | CAS Common Chemistry |
| 150.297 g/mol | RDKit | |
| Density | 0.95 g/cm³ | CAS Common Chemistry |
| 0.949 g/cm3 | CAS Common Chemistry | |
| Name | Benzyldimethylsilane | CAS Common Chemistry |
| Canonical SMILES | C=1C=CC(=CC1)C[SiH](C)C | CAS Common Chemistry |
| InChI | InChI=1S/C9H14Si/c1-10(2)8-9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3 | CAS Common Chemistry |
| InChI Key | InChIKey=USQQZWZBVGCDBX-UHFFFAOYSA-N | CAS Common Chemistry |
| Heavy Atom Count | 10 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 1 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | 2.255 | RDKit |
| Molar Refractivity | 49.02300000000003 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.3333 | RDKit |
| 0.33 | chempirical lib | |
| Exact Mass | 150.086476978 g/mol | RDKit |
| Boiling Point | 70 °C @ 15 Torr | CAS Common Chemistry |
Spectral Data
NMR, IR, and Mass spectral data
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.
External Resources
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MW = 150.30 g/mol; density = 0.950 g/mL. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C9H14Si.
