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1-Butyl-3-methylimidazolium bromide

Catalog Number
ACM85100772
CAS Number
85100-77-2
Product Name
1-Butyl-3-methylimidazolium bromide
Structure
Category
Electrolytes; Battery Materials; Other Electronic Materials
Synonyms
BMIMBr
Description
1-Butyl-3-methylimidazolium bromide is a neutral ionic liquid. It can be used as a solvent for the preparation of 1,2,4,5-substituted imidazoles.
IUPAC Name
1-butyl-3-methylimidazol-3-ium;bromide
Molecular Weight
219.13
Molecular Formula
C8H15BrN2
Canonical SMILES
CCCCN1C=C[N+](=C1)C.[Br-]
InChI
1S/C8H15N2.BrH/c1-3-4-5-10-7-6-9(2)8-10;/h6-8H,3-5H2,1-2H3;1H/q+1;/p-1
InChI Key
KYCQOKLOSUBEJK-UHFFFAOYSA-M
Melting Point
37 °C
Flash Point
Not applicable
Purity
>98.0%(T)(HPLC)
Appearance
White to Orange to Green powder to lump
Application
CAS: 85100-77-2, MF: C8H15BrN2, MW: 219.12
Storage
Store under inert gas, -20℃
Chemical Formula
[Bmim]Br
Complexity
93.3
Covalently-Bonded Unit Count
2
Exact Mass
218.04186g/mol
Formal Charge
0
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
Heavy Atom Count
11
MDL Number
MFCD03427611
MeSH Entry Terms
(bmim)Br;(bmim)Cl;1-butyl-3-methylimidazolium bromide;1-butyl-3-methylimidazolium chloride;1-butyl-3-methylimidazolium methylsulfate;1-n-butyl-3-methylimidazolium chloride;1H-imidazolium, 3-butyl-1-methyl-, chloride (1:1);3-butyl-1-methylimidazolium chloride;BmimCl;butylmethylimidazolium chloride
Monoisotopic Mass
218.04186g/mol
Precautionary Statements
P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.
Refractive Index
n20/D 1.428
Rotatable Bond Count
3
Signal Word
Warning
Specific Gravity
1.12
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