2-Bromoethyldimethylamine

HCID 17864

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Basic information

CAS: 5459-68-7
Standard SMILES: CN(C)CCBr
InChIKey: LVCHXPHUKPLVRQ-UHFFFAOYSA-N
Molecular formula: C4H10BrN
Average molar mass: 152.03 g/mol
Monoisotopic mass: 150.99966142

Names & identifiers

Preferred name: 2-Bromoethyldimethylamine
IUPAC: 2-bromo-N,N-dimethylethanamine
English name: 2-bromoethyldimethylamine
Molecular formula: C4H10BrN
Molecular weight: 152.03

Names & synonyms

5459-68-72-bromo-N,N-dimethylethanamine2-Bromoethyldimethylamine2-Bromo-N,N-dimethylethan-1-amine(2-bromoethyl)dimethylamineEthanamine, 2-bromo-N,N-dimethyl-4Z7Z6J7F7RNSC-6208EINECS 226-732-2AI3-52359DTXSID90203023NSC 6208

Show more names

2-bromoethyldimethylamine HBr(2-bromomethyl) dimethylamine2-(N,N-dimethylamino)ethyl bromide

RefChem:85874DTXCID90125514226-732-22-DIMETHYLAMINOETHYL BROMIDE2-bromo-N,N-dimethyl-ethanamineMFCD07783207Ethanamine,2-bromo-N,N-dimethyl-Dimethylaminoathylbromid

Database identifiers

CAS: 5459-68-7
PubChem CID: 17864
DTXSID: DTXSID90203023
UNII: 4Z7Z6J7F7R
EC Number: 226-732-2
Nikkaji: J210.519E

Properties

Computed structural properties

XLogP: 1
Topological polar surface area: 3.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 2
Heavy atoms: 6
Formal charge: 0
Complexity: 28.7

Physicochemical properties

Boiling point: 33 · 33-35 °C(Press: 14 Torr)
Density: 1.322 · 1.322±0.06 g/cm3(Predicted)
pka: 8.17 · 8.17±0.28(Predicted)
FDA UNII: 4 Z7Z6J7F7R · 4Z7Z6J7F7R
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338

Safety & regulation

Safety data

Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H302-H315-H319-H335
Precautionary statements: P261-P305+P351+P338

Chemistry & industry

Applications

Uses2-Bromo-N,N-dimethylethanamine is a useful research chemical used in the synthesis and evaluation of hydroxyadenines as interferon inducers with improved oral bioavailabilities.