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Molecule
Dimethylamine-Borane
CAS: 74-94-2 · C2H10BN
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 74-94-2
- Molecular Formula
- C2H10BN
- Molecular Mass
- 58.92 g/mol
Identifiers
CAS Registry Number
74-94-2
SMILES
[BH3-][NH+](C)C
InChI Key
RUOMFVPJBOADHA-UHFFFAOYSA-N
InChI
InChI=1S/C2H10BN/c1-4(2)3/h4H,1-3H3
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
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 58.92 g/mol | CAS Common Chemistry |
| 58.92099999999999 g/mol | RDKit | |
| 59.09062972 g/mol | RDKit | |
| 58.921 g/mol | RDKit | |
| Canonical SMILES | [H-][B+3]([H-])([H-])[NH](C)C | CAS Common Chemistry |
| InChI | InChI=1S/C2H10BN/c1-4(2)3/h4H,1-3H3 | CAS Common Chemistry |
| InChI Key | InChIKey=RUOMFVPJBOADHA-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 36 °C @ Solvent: Ligroine | CAS Common Chemistry |
| Name | Dimethylamine-borane | CAS Common Chemistry |
| Heavy Atom Count | 4 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 4.44 Ų | RDKit |
| 4.36 Ų | chempirical lib | |
| LogP | -2.5886999999999993 | RDKit |
| -2.5887 | RDKit | |
| Molar Refractivity | 22.74969999999999 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 58.919 g/mol | chempirical lib |
| Boiling Point | 59-60 °C @ 1-2 Torr | CAS Common Chemistry |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
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2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
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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.
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MW = 58.92 g/mol. Edit any field — others recompute live.
