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1-dodecyl-3-methylimidazolium chloride - 99%, high purity , CAS No.114569-84-5

    Grade & Purity:
  • ≥99%
In stock
Item Number
D188991
Grouped product items
SKU Size
Availability
Price Qty
D188991-5g
5g
3
$49.90
D188991-25g
25g
3
$139.90
D188991-100g
100g
2
$399.90
View related series
Imidazolium salt (90)

Basic Description

Synonyms MFCD03427606 | DTXSID9047918 | NCGC00258149-01 | 1-dodecyl-3-methylimidazol-3-ium;chloride | ZB1676 | Tox21_200595 | 1-DODECYL-3-METHYLIMIDAZOLIUMCHLORIDE | D5352 | 1-dodecyl-3-methyl-1H-imidazol-3-ium chloride | 1H-Imidazolium, 1-dodecyl-3-methyl-, chlor
Specifications & Purity ≥99%
Storage Temp Room temperature
Shipped In Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Organoheterocyclic compounds
Class Azoles
Subclass Imidazoles
Intermediate Tree Nodes Substituted imidazoles
Direct Parent N-substituted imidazoles
Alternative Parents Heteroaromatic compounds  Azacyclic compounds  Organopnictogen compounds  Organonitrogen compounds  Organic chloride salts  Hydrocarbon derivatives  
Molecular Framework Aromatic heteromonocyclic compounds
Substituents N-substituted imidazole - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organic chloride salt - Organic salt - Organonitrogen compound - Aromatic heteromonocyclic compound
Description This compound belongs to the class of organic compounds known as n-substituted imidazoles. These are heterocyclic compounds containing an imidazole ring substituted at position 1.
External Descriptors Not available

Associated Targets(Human)

A498 (42825 Activities)
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ACHN (49357 Activities)
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CAKI-1 (44928 Activities)
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CCRF-CEM (65223 Activities)
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COLO 205 (50209 Activities)
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DU-145 (51482 Activities)
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HT-29 (80576 Activities)
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K562 (73714 Activities)
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KM12 (47707 Activities)
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M14 (47487 Activities)
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MCF7 (126967 Activities)
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MDA-MB-468 (9477 Activities)
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MOLT-4 (49676 Activities)
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OVCAR-3 (48710 Activities)
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OVCAR-4 (44535 Activities)
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OVCAR-5 (45555 Activities)
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OVCAR-8 (47708 Activities)
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PC-3 (62116 Activities)
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RXF 393 (41971 Activities)
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SF-295 (48000 Activities)
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SK-MEL-2 (46422 Activities)
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SK-MEL-28 (48833 Activities)
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SK-MEL-5 (47095 Activities)
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SK-OV-3 (52876 Activities)
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SN12C (47755 Activities)
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SNB-19 (46794 Activities)
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TK-10 (45540 Activities)
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U-251 (51189 Activities)
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UACC-257 (46019 Activities)
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UACC-62 (47335 Activities)
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UO-31 (46270 Activities)
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786-0 (47912 Activities)
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A549 (127892 Activities)
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NCI/ADR-RES (33767 Activities)
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T47D (39041 Activities)
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EKVX (44102 Activities)
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NCI-H322M (45589 Activities)
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HCC 2998 (41480 Activities)
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HCT-116 (91556 Activities)
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HOP-92 (41141 Activities)
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NCI-H460 (60772 Activities)
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SF-268 (49410 Activities)
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IGROV-1 (47897 Activities)
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LOX IMVI (44321 Activities)
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HOP-62 (47048 Activities)
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MDA-MB-435 (38290 Activities)
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Malme-3M (44254 Activities)
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MDA-MB-231 (73002 Activities)
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SNB-75 (44215 Activities)
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NCI-H226 (44470 Activities)
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Associated Targets(non-human)

pol Human immunodeficiency virus type 1 integrase (9041 Activities)
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Mechanisms of Action

Mechanism of Action Action Type target ID Target Name Target Type Target Organism Binding Site Name References

Names and Identifiers

Pubchem Sid 488192509
Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488192509
IUPAC Name 1-dodecyl-3-methylimidazol-3-ium;chloride
INCHI InChI=1S/C16H31N2.ClH/c1-3-4-5-6-7-8-9-10-11-12-13-18-15-14-17(2)16-18;/h14-16H,3-13H2,1-2H3;1H/q+1;/p-1
InChIKey OPXNHKQUEXEWAM-UHFFFAOYSA-M
Smiles CCCCCCCCCCCCN1C=C[N+](=C1)C.[Cl-]
Isomeric SMILES CCCCCCCCCCCCN1C=C[N+](=C1)C.[Cl-]
Molecular Weight 286.88
Reaxy-Rn 7556966
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=7556966&ln=

Certificates(CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

8 results found

Lot Number Certificate Type Date Item
E2329094 Certificate of Analysis Apr 14, 2023 D188991
E2329077 Certificate of Analysis Apr 14, 2023 D188991
E2329089 Certificate of Analysis Apr 14, 2023 D188991
E2329082 Certificate of Analysis Apr 14, 2023 D188991
E2329085 Certificate of Analysis Apr 14, 2023 D188991
E2329081 Certificate of Analysis Apr 14, 2023 D188991
E2009041 Certificate of Analysis Mar 08, 2023 D188991
B2321455 Certificate of Analysis Mar 02, 2023 D188991

Chemical and Physical Properties

Sensitivity Moisture sensitive
Melt Point(°C) 46.0 to 50.0 °C
Molecular Weight 286.900 g/mol
XLogP3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 11
Exact Mass 286.218 Da
Monoisotopic Mass 286.218 Da
Topological Polar Surface Area 8.800 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 182.000
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
The total count of all stereochemical bonds 0
Covalently-Bonded Unit Count 2

Alternative Products

Citations of This Product

1. Han Jia, Peng Lian, Xu Leng, Yugui Han, Qiuxia Wang, Kaile Jia, Xinpeng Niu, Muzhi Guo, Hui Yan, Kaihe Lv.  (2019)  Mechanism studies on the application of the mixed cationic/anionic surfactant systems to enhance oil recovery.  FUEL,  258  (116156). 

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