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Molecule
Bromotriethylsilane
CAS: 1112-48-7 · C6H15BrSi
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 1112-48-7
- Molecular Formula
- C6H15BrSi
- Molecular Mass
- 195.18 g/mol
Identifiers
CAS Registry Number
1112-48-7
SMILES
CC[Si](Br)(CC)CC
InChI Key
UCKORWKZRPKRQE-UHFFFAOYSA-N
InChI
InChI=1S/C6H15BrSi/c1-4-8(7,5-2)6-3/h4-6H2,1-3H3
Names and Synonyms
- Bromotriethylsilane Common Name
- Silane, bromotriethyl- Synonym
- Bromotriethylsilane Synonym
- Triethylbromosilane Synonym
- Triethylsilyl bromide Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 195.18 g/mol | CAS Common Chemistry |
| 195.17599999999996 g/mol | RDKit | |
| 195.176 g/mol | RDKit | |
| Density | 1.14 g/cm³ | CAS Common Chemistry |
| 1.140 g/cm3 | CAS Common Chemistry | |
| Canonical SMILES | Br[Si](CC)(CC)CC | CAS Common Chemistry |
| InChI | InChI=1S/C6H15BrSi/c1-4-8(7,5-2)6-3/h4-6H2,1-3H3 | CAS Common Chemistry |
| InChI Key | InChIKey=UCKORWKZRPKRQE-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | -50 °C | CAS Common Chemistry |
| Name | Bromotriethylsilane | CAS Common Chemistry |
| Heavy Atom Count | 8 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 3 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | 3.3865000000000016 | RDKit |
| 3.3865 | RDKit | |
| 3.59 | chempirical lib | |
| Molar Refractivity | 46.12400000000003 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 194.01263910999998 g/mol | RDKit |
| Boiling Point | 66-67 °C @ 24 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 = 195.18 g/mol; density = 1.140 g/mL. Edit any field — others recompute live.
