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Dimethylamine-Borane
CAS: 74-94-2 | C2H10BN
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
74-94-2
Molecular Formula:
C2H10BN
Molecular Weight:
58.92099999999999 g/mol
Names and Synonyms:
Dimethylamine-Borane
Synonym
Boron, trihydro(N-methylmethanamine)-, (T-4)-
Synonym
Dimethylamine, compd. with borane (1:1)
Synonym
Methanamine, N-methyl-, compd. with borane (1:1)
Synonym
Dimethylamine, compd. with BH3
Synonym
Borane, compd. with dimethylamine (1:1)
Synonym
Borane, compd. with N-methylmethanamine (1:1)
Synonym
Methanamine, N-methyl-, boron complex
Synonym
(T-4)-Trihydro(N-methylmethanamine)boron
Synonym
Dimethylamine-borane
Synonym
Dimethylamine compound with borane (1:1)
Synonym
NSC 10218
Synonym
NSC 53321
Synonym
(Dimethylamine)trihydroboron
Synonym
Identifiers:
SMILES:
[BH3-][NH+](C)C
InChI:
InChI=1S/C2H10BN/c1-4(2)3/h4H,1-3H3
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
Physical Properties
| Property | Value | Source |
|---|---|---|
| molecular_mass | 58.92 g/mol | Legacy Database |
| cas-boiling-point | 59-60 °C @ Press: 1-2 Torr None | Legacy Database |
| cas-canonical-smile | [H-][B+3]([H-])([H-])[NH](C)C None | Legacy Database |
| cas-inchi | InChI=1S/C2H10BN/c1-4(2)3/h4H,1-3H3 None | Legacy Database |
| cas-inchi-key | InChIKey=RUOMFVPJBOADHA-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | 36 °C @ Solvent: Ligroine None | Legacy Database |
| cas-name | Dimethylamine-borane None | Legacy Database |
| LogP | -2.5886999999999993 | RDKit |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 58.92099999999999 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 59.09062972 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 4 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 0 count | RDKit |
| Hydrogen Bond Donors | 1 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 0 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 4.44 Ų | RDKit |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 22.74969999999999 | RDKit |