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N,N′-Bis(1,1-Dimethylethyl)Silanediamine
CAS: 186598-40-3 | C8H22N2Si
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
186598-40-3
Molecular Formula:
C8H22N2Si
Molecular Mass:
174.36 g/mol
Names and Synonyms:
N,N′-Bis(1,1-Dimethylethyl)Silanediamine
Silanediamine, N,N′-bis(1,1-dimethylethyl)-
N,N′-Bis(1,1-dimethylethyl)silanediamine
Bis(tert-butylamino)silane
BTBAS
N,N′-Bis-tert-butylsilanediamine
Identifiers:
SMILES:
CC(C)(C)N[SiH2]NC(C)(C)C
InChI:
InChI=1S/C8H22N2Si/c1-7(2,3)9-11-10-8(4,5)6/h9-10H,11H2,1-6H3
Key Properties
Boiling Point
167 °C
CAS Common Chemistry
Density
0.82 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 | 174.36 g/mol | CAS Common Chemistry |
| 174.364 g/mol | RDKit | |
| 174.155225234 g/mol | RDKit | |
| Density | 0.82 g/cm³ | CAS Common Chemistry |
| 0.816 g/cm3 | CAS Common Chemistry | |
| Boiling Point | 167 °C | CAS Common Chemistry |
| Canonical SMILES | N([SiH2]NC(C)(C)C)C(C)(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C8H22N2Si/c1-7(2,3)9-11-10-8(4,5)6/h9-10H,11H2,1-6H3 | CAS Common Chemistry |
| InChI Key | InChIKey=VYIRVGYSUZPNLF-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | N,N′-Bis(1,1-dimethylethyl)silanediamine | CAS Common Chemistry |
| Heavy Atom Count | 11 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 24.06 Ų | RDKit |
| LogP | 0.7613999999999999 | RDKit |
| Molar Refractivity | 54.32140000000004 | RDKit |
