1-Butyl-2,3-dimethyl-3-imidazolium Chloride - CAS 98892-75-2
Catalog: |
BB042225 |
Product Name: |
1-Butyl-2,3-dimethyl-3-imidazolium Chloride |
CAS: |
98892-75-2 |
Synonyms: |
1-butyl-2,3-dimethylimidazol-3-ium;chloride; 1-butyl-2,3-dimethylimidazol-3-ium;chloride |
IUPAC Name: | 1-butyl-2,3-dimethylimidazol-3-ium;chloride |
Description: | 1-Butyl-2,3-dimethylimidazolium chloride can be used as a solvent in the chemical modification of polysaccharide cellulose. It also can be used to prepare mesoporous ZnAl2O4 nanomaterials, which are used as catalysts or catalyst supports. |
Molecular Weight: | 188.70 |
Molecular Formula: | C9H17ClN2 |
Canonical SMILES: | CCCCN1C=C[N+](=C1C)C.[Cl-] |
InChI: | InChI=1S/C9H17N2.ClH/c1-4-5-6-11-8-7-10(3)9(11)2;/h7-8H,4-6H2,1-3H3;1H/q+1;/p-1 |
InChI Key: | HHHYPTORQNESCU-UHFFFAOYSA-M |
Melting Point: | 99 °C |
Flash Point: | Not applicable |
Purity: | > 98.0 % (T) (HPLC) |
Appearance: | White to orange to green powder to crystal |
Storage: | Store under inert gas, -20 °C |
MDL: | MFCD03093291 |
LogP: | -1.57490 |
Refractive Index: | n20/D 1.578 |
Precautionary Statement: | 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. |
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PMID | Publication Date | Title | Journal |
21808767 | 20110914 | Oscillating electrochemical reaction in copper-containing imidazolium ionic liquids | Physical chemistry chemical physics : PCCP |
21108009 | 20110601 | A novel direct equipartition ray design (EquRay) procedure for toxicity interaction between ionic liquid and dichlorvos | Environmental science and pollution research international |
21459366 | 20110515 | Conversion of hexose into 5-hydroxymethylfurfural in imidazolium ionic liquids with and without a catalyst | Carbohydrate research |
19520508 | 20091030 | Effect of ionic liquid on the toxicity of pesticide to Vibrio-qinghaiensis sp.-Q67 | Journal of hazardous materials |
Complexity: | 114 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 188.1080262 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 188.1080262 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 8.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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