1,3-Bis(2,4,6-trimethylphenyl)imidazolium Chloride - CAS 141556-45-8
Catalog: |
BB009192 |
Product Name: |
1,3-Bis(2,4,6-trimethylphenyl)imidazolium Chloride |
CAS: |
141556-45-8 |
Synonyms: |
1,3-bis(2,4,6-trimethylphenyl)imidazol-1-ium;chloride; 1,3-bis(2,4,6-trimethylphenyl)imidazol-1-ium;chloride |
IUPAC Name: | 1,3-bis(2,4,6-trimethylphenyl)imidazol-1-ium;chloride |
Description: | 1,3-Bis(2,4,6-trimethylphenyl)imidazolium Chloride (CAS# 141556-45-8) is a reactant tin the synthesis of bio-diesel, as a renewable energy source, from a variety of fat and oils. |
Molecular Weight: | 340.89 |
Molecular Formula: | C21H25ClN2 |
Canonical SMILES: | CC1=CC(=C(C(=C1)C)N2C=C[N+](=C2)C3=C(C=C(C=C3C)C)C)C.[Cl-] |
InChI: | InChI=1S/C21H25N2.ClH/c1-14-9-16(3)20(17(4)10-14)22-7-8-23(13-22)21-18(5)11-15(2)12-19(21)6;/h7-13H,1-6H3;1H/q+1;/p-1 |
InChI Key: | OTOSIXGMLYKKOW-UHFFFAOYSA-M |
Storage: | Keep in dark place, Inert atmosphere, Room temperature |
MDL: | MFCD02684541 |
LogP: | 1.60840 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113045533-A | Synthetic method of cyclic carbonate | 20210407 |
CN-112812133-A | Alpha, alpha-difluoroallyl organometallic compound and preparation method and application thereof | 20210128 |
CN-112871219-A | Flame-retardant composition for hydrogenation catalysis and use method thereof | 20210114 |
CN-112174995-A | Double-silicon compound, preparation method and application thereof | 20201027 |
EP-3901135-A1 | Sulfur extrusion from disulfides by carbenes | 20200422 |
PMID | Publication Date | Title | Journal |
21911215 | 20111108 | Application of silver N-heterocyclic carbene complexes in O-glycosidation reactions | Carbohydrate research |
17497786 | 20070606 | A mixed-valent, Fe(II)Fe(I), diiron complex reproduces the unique rotated state of the [FeFe]hydrogenase active site | Journal of the American Chemical Society |
16508201 | 20060301 | Cyano-phosphorylation of aldehydes catalyzed by a nucleophilic N-heterocyclic carbene | Chemical & pharmaceutical bulletin |
15989352 | 20050708 | Theoretical and experimental investigation of the basicity of phosphino(silyl)carbenes | The Journal of organic chemistry |
15340627 | 20040907 | Electrochemical reduction of an imidazolium cation: a convenient preparation of imidazol-2-ylidenes and their observation in an ionic liquid | Chemical communications (Cambridge, England) |
Complexity: | 335 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 340.1706265 |
Formal Charge: | 0 |
Heavy Atom Count: | 24 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 340.1706265 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 8.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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