Name: 1-Allyl-3-methylimidazolium bromide
SKU: 31410-07-8

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Basic Information

Molecular Structure:
CAS No.:	31410-07-8
Name:	1-Allyl-3-methylimidazolium bromide
Article Data:	20

Formula:	C₇H₁₁N₂Br
Molecular Weight:	203.082
Synonyms:	1H-Imidazolium,1-methyl-3-(2-propenyl)-, bromide (9CI);Imidazolium, 3-allyl-1-methyl-,bromide (8CI);1-Allyl-3-methyl-1H-imidazolium bromide;1H-Imidazolium,1-methyl-3-(2-propen-1-yl)-, bromide (1:1);
EINECS:	200-144-5
Melting Point:	-52.5 °C
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26
PSA:	8.81000
LogP:	-2.49740

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Specification

The 1-Allyl-3-methylimidazolium bromide, with the CAS registry number 31410-07-8, is also known as 1H-Imidazolium, 1-methyl-3-(2-propen-1-yl)-, bromide (1:1). It belongs to the product categories of Chemical Synthesis; Imidazolium; Ionic Liquids. This chemical's molecular formula is C₇H₁₁N₂Br and molecular weight is 203.08. What's more, its systematic name is 3-Methyl-1-(prop-2-en-1-yl)-1H-imidazol-3-ium bromide. Physical properties about this chemical are: (1)#H bond acceptors: 2 #H bond donors: 0; (2)#Freely Rotating Bonds: 2 Polar Surface Area: 8.81 Å².

When you are using 1-Allyl-3-methylimidazolium bromide, please be cautious about it as the following:
As a chemical, it is irritating to eyes, respiratory system and skin. In addition, this chemical may cause inflammation to the skin or other mucous membranes. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: [Br-].C=C\Cn1cc[n+](c1)C
(2) InChI: InChI=1/C7H11N2.BrH/c1-3-4-9-6-5-8(2)7-9;/h3,5-7H,1,4H2,2H3;1H/q+1;/p-1
(3) InChIKey: KLFDZFIZKMEUGI-REWHXWOFAL