N,N-Dimethyl-beta-bromoethylamine hydrobromide
Basic information
- CAS
2862-39-7- Standard SMILES
C[NH+](C)CCBr.[Br-]- InChIKey
MFRUVSDIZTZFFL-UHFFFAOYSA-N- Molecular formula
- C4H11Br2N
- Average molar mass
- 232.94 g/mol
- Monoisotopic mass
- 230.92582
Overview
See also: 2-Bromoethyldimethylammonium bromide (preferred).
Names & identifiers
- Preferred name
- N,N-Dimethyl-beta-bromoethylamine hydrobromide
- IUPAC
- 2-bromoethyl(dimethyl)azanium bromide
- English name
- B-dimethylaminoethyl bromide hydrobromide
- Molecular formula
- C4H11Br2N
- Molecular weight
- 232.94
Names & synonyms
EINECS 220-680-4N,N-Dimethyl-beta-bromoethylamine hydrobromideEthanamine, 2-bromo-N,N-dimethyl-, hydrochlorideETHYLAMINE, 2-BROMO-N,N-DIMETHYL-, HYDROBROMIDE2-bromoethyl(dimethyl)azanium;bromideAKOS0243641222-bromo-N,N-dimethylethan-1-aminium bromideNS000835832-(Dimethylamino)Ethyl Bromide HydrobromideN, N-dimethylamine bromoethane hydrobromide2-bromoethyl(dimethyl)azaniumDimethylaminoethyl bromide HBr
Show more names
2-BROMO-N,N-DIMETHYLETHANAMINE HBR2-bromoethyldimethylammonium bromide2-bromoethyl(dimethyl)azanium bromide2-BroMo-N,N-diMethylethanaMiniuMbroMide(2-BroMoethyl)diMethylaMine hydrobroMideB-DIMETHYLAMINOETHYL BROMIDE HYDROBROMIDE
Database identifiers
- CAS
2862-39-7- PubChem CID
- 17863
Properties
Computed structural properties
- Topological polar surface area
- 4.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 28.7
Physicochemical properties
- Melting point
- 188.5 · 188.5-188.9 °C(Solv: ethyl acetate (141-78-6); ethanol, 95% (64-17-5)(8:5))
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- Appearance
- White to off-white Solid
- InChI
- InChI=1S/C4H10BrN.BrH/c1-6(2)4-3-5;/h3-4H2,1-2H3;1H
- InChIKey
- MFRUVSDIZTZFFL-UHFFFAOYSA-N
- SMILES
- C(CBr)N(C)C.Br
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Applications
UsesB-dimethylaminoethyl bromide hydrobromide is often used as a reagent in organic synthesis reactions. It can be used as a quaternary ammonium salt reagent to prepare quaternary ammonium compounds. In addition, it can also be used to synthesize other organic compounds, such as drugs, dyes and surfactants.
Upstream & downstream products
Downstream products
Related reactions
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Compound notes
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