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1,1,2,2-Diborane(4)Tetramine, N1,N1,N1′,N1′,N2,N2,N2′,N2′-Octamethyl-
CAS: 1630-79-1 | C8H24B2N4
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
1630-79-1
Molecular Formula:
C8H24B2N4
Molecular Mass:
197.93 g/mol
Names and Synonyms:
1,1,2,2-Diborane(4)Tetramine, N1,N1,N1′,N1′,N2,N2,N2′,N2′-Octamethyl-
1,1,2,2-Diborane(4)tetramine, N1,N1,N1′,N1′,N2,N2,N2′,N2′-octamethyl-
Diborane(4), tetrakis(dimethylamino)-
Diborane(4)tetramine, octamethyl-
Tetrakis(dimethylamino)diborane(4)
1,1,2,2-Tetrakis(dimethylamino)diborane(4)
Tetrakis(dimethylamino)diborane
Tetrakis(dimethylamino)diboron
NSC 220326
NSC 665722
Identifiers:
SMILES:
CN(C)B(B(N(C)C)N(C)C)N(C)C
InChI:
InChI=1S/C8H24B2N4/c1-11(2)9(12(3)4)10(13(5)6)14(7)8/h1-8H3
Key Properties
Boiling Point
56-57 °C @ Press: 2 Torr
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 | 197.93 g/mol | CAS Common Chemistry |
| 197.932 g/mol | RDKit | |
| 198.21870756799999 g/mol | RDKit | |
| Boiling Point | 56-57 °C @ Press: 2 Torr | CAS Common Chemistry |
| Canonical SMILES | B(B(N(C)C)N(C)C)(N(C)C)N(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C8H24B2N4/c1-11(2)9(12(3)4)10(13(5)6)14(7)8/h1-8H3 | CAS Common Chemistry |
| InChI Key | InChIKey=KMCDRSZVZMXKRL-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | 1,1,2,2-Diborane(4)tetramine, N1,N1,N1′,N1′,N2,N2,N2′,N2′-octamethyl- | CAS Common Chemistry |
| Heavy Atom Count | 14 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 5 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 12.96 Ų | RDKit |
| LogP | -0.7123999999999968 | RDKit |
| Molar Refractivity | 66.25600000000004 | RDKit |
