1-Ethyl-2,3-dimethyl-3-imidazolium Bromide - CAS 98892-76-3

Catalog:	BB042226
Product Name:	1-Ethyl-2,3-dimethyl-3-imidazolium Bromide
CAS:	98892-76-3
Synonyms:	1-ethyl-2,3-dimethylimidazol-3-ium;bromide; 1-ethyl-2,3-dimethylimidazol-3-ium;bromide

Technical Data

Patents

Computed Properties

IUPAC Name:	1-ethyl-2,3-dimethylimidazol-3-ium;bromide
Description:	1-Ethyl-2,3-dimethyl-3-imidazolium Bromide (CAS# 98892-76-3 ) is a useful research chemical.
Molecular Weight:	205.10
Molecular Formula:	C7H13BrN2
Canonical SMILES:	CCN1C=C[N+](=C1C)C.[Br-]
InChI:	InChI=1S/C7H13N2.BrH/c1-4-9-6-5-8(3)7(9)2;/h5-6H,4H2,1-3H3;1H/q+1;/p-1
InChI Key:	GITMVCYKHULLDM-UHFFFAOYSA-M
MDL:	MFCD03427614
LogP:	-2.35510

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Related Functional Groups

Imidazoles

[1005626-64-1]
3-(1,3-Dimethylpyrazol-4-yl)-5-[(1-methylpyrazol-4-yl)methylidene]-2-sulfanylideneimidazolidin-4-one
[64038-58-0]
1-Cyclohexyl-1,3-dihydro-2H-imidazole-2-thione
[74478-96-9]
Ethyl 2,4-dibromo-1H-imidazole-5-carboxylate
[177760-04-2]
Ethyl 2-Amino-1-methyl-1H-imidazole-5-carboxylate
[287917-54-8]
3-(2-Furylmethyl)-2-mercapto-3,5-dihydro-4H-imidazol-4-one
[63875-06-9]
1-Methyl-2-phenyl-4-(trifluoromethyl)-1H-imidazole

Complexity:	92.9
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	204.02621
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	204.02621
Rotatable Bond Count:	1
Topological Polar Surface Area:	8.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0