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| Name |
2-Bromo-N,N-dimethylethylamine hydrobromide |
EINECS | 220-680-4 |
| CAS No. | 2862-39-7 | Density | N/A |
| PSA | 3.24000 | LogP | 1.90100 |
| Solubility | N/A | Melting Point |
188.5-188.9 °C(Solv: ethyl acetate (141-78-6); ethanol, 95% (64-17-5)(8:5)) |
| Formula | C4H11Br2N | Boiling Point | 121.7 °C at 760 mmHg |
| Molecular Weight | 232.946 | Flash Point | 27.4 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Ethanamine,2-bromo-N,N-dimethyl-, hydrobromide (9CI);Ethylamine, 2-bromo-N,N-dimethyl-,hydrobromide (6CI,7CI,8CI);(2-Bromoethyl)dimethylamine hydrobromide;2-(Dimethylamino)ethyl bromide hydrobromide;2-(N,N-Dimethylamino)ethyl bromidehydrobromide;2-Dimethylamino-1-bromoethane hydrobromide;N,N-Dimethyl-beta-bromoethylamine hydrobromide;Ethanamine,2-bromo-N,N-dimethyl-, hydrobromide (1:1); |
2-Bromo-N,N-dimethylethylamine hydrobromide Synthetic route
| Conditions | Yield |
|---|---|
| With hydrogen bromide at 0℃; und folgendes Kochen; |
- 2862-39-7
2-(dimethylamino)ethyl bromide hydrobromide
- 138335-08-7
(3R,4S)-3-Hydroxy-4-(4-methoxy-phenyl)-7-trifluoromethyl-1,3,4,5-tetrahydro-benzo[b]azepin-2-one
- 138337-25-4, 138383-41-2
cis-3-hydroxy-1-<2-(dimethylamino)ethyl>-1,3,4,5-tetrahydro-4-(4-methoxyphenyl)-7-(trifluoromethyl)-2H-1-benzazepin-2-one
| Conditions | Yield |
|---|---|
| With barium dihydroxide; benzyltrimethylammonium chloride In dichloromethane; water for 16h; | 93% |
- 2862-39-7
2-(dimethylamino)ethyl bromide hydrobromide
| Conditions | Yield |
|---|---|
| Stage #1: 2-ethyl-4-methyl-N-(4-(2-oxo-1,2,3,4-tetrahydroquinolin-6-yl)thiazol-2-yl)oxazole-5-carboxamide With sodium hydride In N,N-dimethyl-formamide; mineral oil at 0℃; for 0.166667h; Inert atmosphere; Stage #2: 2-(dimethylamino)ethyl bromide hydrobromide In N,N-dimethyl-formamide; mineral oil at 20℃; for 21.5h; | 90% |
- 33543-78-1
ethyl 1H-imidazole-2-carboxylate
- 2862-39-7
2-(dimethylamino)ethyl bromide hydrobromide
| Conditions | Yield |
|---|---|
| Stage #1: ethyl 1H-imidazole-2-carboxylate With potassium carbonate In acetonitrile for 0.5h; Stage #2: 2-(dimethylamino)ethyl bromide hydrobromide In acetonitrile at 80℃; for 3h; | 87.7% |
| Stage #1: ethyl 1H-imidazole-2-carboxylate With potassium carbonate In acetonitrile for 0.5h; Stage #2: 2-(dimethylamino)ethyl bromide hydrobromide In acetonitrile at 80℃; for 3h; | 87.7% |
- 2862-39-7
2-(dimethylamino)ethyl bromide hydrobromide
| Conditions | Yield |
|---|---|
| Stage #1: 2,4-dimethyl-N-(4-(2-oxo-1,2,3,4-tetrahydroquinolin-6-yl)thiazol-2-yl)oxazole-5-carboxamide With sodium hydride In N,N-dimethyl-formamide; mineral oil at 0℃; for 0.166667h; Inert atmosphere; Stage #2: 2-(dimethylamino)ethyl bromide hydrobromide In N,N-dimethyl-formamide; mineral oil at 20℃; for 21.5h; | 86% |
- 2862-39-7
2-(dimethylamino)ethyl bromide hydrobromide
| Conditions | Yield |
|---|---|
| Stage #1: 2-isopropyl-4-methyl-N-(4-(2-oxo-1,2,3,4-tetrahydroquinolin-6-yl)thiazol-2-yl)oxazole-5-carboxamide With sodium hydride In N,N-dimethyl-formamide; mineral oil at 0℃; for 0.166667h; Inert atmosphere; Stage #2: 2-(dimethylamino)ethyl bromide hydrobromide In N,N-dimethyl-formamide; mineral oil at 20℃; for 21.5h; | 83% |
- 2862-39-7
2-(dimethylamino)ethyl bromide hydrobromide
| Conditions | Yield |
|---|---|
| With caesium carbonate In N,N-dimethyl-formamide at 50℃; | 79% |
- 2862-39-7
2-(dimethylamino)ethyl bromide hydrobromide
- 108-95-2
phenol
- 13468-02-5
dimethyl(2-phenoxyethyl)amine
| Conditions | Yield |
|---|---|
| With sodium hydride In diethyl ether; N,N-dimethyl-formamide for 15h; Ambient temperature; | 78% |
| Conditions | Yield |
|---|---|
| Stage #1: C19H17ClN2O2 With sodium hydride In N,N-dimethyl-formamide; mineral oil at 40℃; for 0.5h; Stage #2: 2-(dimethylamino)ethyl bromide hydrobromide In N,N-dimethyl-formamide; mineral oil at 40℃; | 78% |
- 328002-54-6
3-allyl-2-thioxo-2,3-dihydro-1H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
- 2862-39-7
2-(dimethylamino)ethyl bromide hydrobromide
- 1239648-04-4
C24H31N3OS
| Conditions | Yield |
|---|---|
| With potassium hydroxide In butanone at 70℃; for 16h; Inert atmosphere; | 75% |
2-Bromo-N,N-dimethylethylamine hydrobromide Specification
The 2-Bromo-N,N-dimethylethanaminium bromide, with the CAS registry number 2862-39-7, is also known as N,N-Dimethyl-beta-bromoethylamine hydrobromide. Its EINECS number is 220-680-4. This chemical's molecular formula is C4H11Br2N and formula weight is 232.94. What's more, its IUPAC name is 2-bromoethyl(dimethyl)azanium bromide. Its classification code is Drug/Therapeutic Agent.
Physical properties of 2-Bromo-N,N-dimethylethanaminium bromide are: (1)ACD/LogP: 1.04; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.49; (4)ACD/LogD (pH 7.4): 0.21; (5)ACD/BCF (pH 5.5): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 12.89; (8)#H bond acceptors: 1; (9)#H bond donors: 0; (10)#Freely Rotating Bonds: 2; (11)Flash Point: 27.4 °C; (12)Enthalpy of Vaporization: 35.98 kJ/mol; (13)Boiling Point: 121.7 °C at 760 mmHg; (14)Vapour Pressure: 14.4 mmHg at 25°C.
Uses of 2-Bromo-N,N-dimethylethanaminium bromide: it can be used to produce dimethyl-(2-phenoxy-ethyl)-amine at the ambient temperature. It will need reagent NaH and solvent dimethylformamide, diethyl ether with the reaction time of 15 hours. The yield is about 78%.
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You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C[NH+](C)CCBr.[Br-]
(2)InChI: InChI=1S/C4H10BrN.BrH/c1-6(2)4-3-5;/h3-4H2,1-2H3;1H
(3)InChIKey: MFRUVSDIZTZFFL-UHFFFAOYSA-N
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