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Molecule
Bis(1,1-Dimethylethyl)Silane
CAS: 30736-07-3 · C8H20Si
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 30736-07-3
- Molecular Formula
- C8H20Si
- Molecular Mass
- 144.33 g/mol
Identifiers
CAS Registry Number
30736-07-3
SMILES
CC(C)(C)[SiH2]C(C)(C)C
InChI Key
ZLKSBZCITVUTSN-UHFFFAOYSA-N
InChI
InChI=1S/C8H20Si/c1-7(2,3)9-8(4,5)6/h9H2,1-6H3
Names and Synonyms
- Bis(1,1-Dimethylethyl)Silane Synonym
- Silane, bis(1,1-dimethylethyl)- Synonym
- Silane, di-tert-butyl- Synonym
- Bis(1,1-dimethylethyl)silane Synonym
- Di-tert-butylsilane Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 144.33 g/mol | CAS Common Chemistry |
| 144.33399999999997 g/mol | RDKit | |
| 144.334 g/mol | RDKit | |
| Density | 0.74 g/cm³ | CAS Common Chemistry |
| 0.740 g/cm3 | CAS Common Chemistry | |
| Boiling Point | 128 °C | CAS Common Chemistry |
| Canonical SMILES | CC(C)(C)[SiH2]C(C)(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C8H20Si/c1-7(2,3)9-8(4,5)6/h9H2,1-6H3 | CAS Common Chemistry |
| InChI Key | InChIKey=ZLKSBZCITVUTSN-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | -38 °C | CAS Common Chemistry |
| Name | Bis(1,1-dimethylethyl)silane | CAS Common Chemistry |
| Heavy Atom Count | 9 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | 2.5920000000000005 | RDKit |
| 2.592 | RDKit | |
| Molar Refractivity | 47.974000000000025 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 144.13342717 g/mol | RDKit |
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 = 144.33 g/mol; density = 0.740 g/mL. Edit any field — others recompute live.