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1-Hexadecyl-3-methylimidazolium Chloride - 96.0%, high purity , CAS No.61546-01-8

1 Citations COA COA
    Grade & Purity:
  • ≥96%
In stock
Item Number
H404551
Grouped product items
SKU Size
Availability
 Price Qty
H404551-5g
5g
2
$9.90
H404551-25g
25g
2
$31.90
H404551-100g
100g
2
$104.90
Wish List
Bulk Order  SDS  DATASHEET  Specification Sheet
View related series
Imidazole ionic liquids (5) Ionic liquid (47)

Basic Description

Synonyms 1-Cetyl-3-methylimidazolium chloride | SCHEMBL295427 | F71870 | CAS-61546-01-8 | 1-methyl-3-hexadecylimidazolium chloride | EQ4UWS7WUN | DTXSID8047923 | NSC747260 | NSC-747260 | 1-methyl-3-hexadecyl imidazolium chloride | NCGC00258154-01 | 3-Hexadecyl-1-m
Specifications & Purity ≥96%
Storage Temp Argon charged

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)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
ACHN (49357 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
CAKI-1 (44928 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
CCRF-CEM (65223 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
COLO 205 (50209 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
DU-145 (51482 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
HT-29 (80576 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
K562 (73714 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
KM12 (47707 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
M14 (47487 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
MCF7 (126967 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
MDA-MB-468 (9477 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
MOLT-4 (49676 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
OVCAR-3 (48710 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
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)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
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)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
NCI/ADR-RES (33767 Activities)
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T47D (39041 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
EKVX (44102 Activities)
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NCI-H322M (45589 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
HCC 2998 (41480 Activities)
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HCT-116 (91556 Activities)
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HOP-92 (41141 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
NCI-H460 (60772 Activities)
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SF-268 (49410 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
IGROV-1 (47897 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
LOX IMVI (44321 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
HOP-62 (47048 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
MDA-MB-435 (38290 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Malme-3M (44254 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
MDA-MB-231 (73002 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
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)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Nakaseomyces glabratus (9108 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Candida parapsilosis (8521 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Candida tropicalis (8381 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Trichosporon asahii (679 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

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 488192510
Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488192510
IUPAC Name 1-hexadecyl-3-methylimidazol-3-ium;chloride
INCHI InChI=1S/C20H39N2.ClH/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-19-18-21(2)20-22;/h18-20H,3-17H2,1-2H3;1H/q+1;/p-1
InChIKey ZCPPLZJPPBIWRU-UHFFFAOYSA-M
Smiles CCCCCCCCCCCCCCCCN1C=C[N+](=C1)C.[Cl-]
Isomeric SMILES CCCCCCCCCCCCCCCCN1C=C[N+](=C1)C.[Cl-]
Molecular Weight 343
Reaxy-Rn 7558047
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=7558047&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.

11 results found

Lot Number Certificate Type Date Item
E2515312 Certificate of Analysis Apr 03, 2025 H404551
E2515313 Certificate of Analysis Apr 03, 2025 H404551
E2515333 Certificate of Analysis Apr 03, 2025 H404551
B2314505 Certificate of Analysis Aug 24, 2022 H404551
B2314525 Certificate of Analysis Aug 24, 2022 H404551
B2314447 Certificate of Analysis Aug 24, 2022 H404551
B2314372 Certificate of Analysis Aug 24, 2022 H404551
B2314504 Certificate of Analysis Aug 24, 2022 H404551
B2314506 Certificate of Analysis Aug 24, 2022 H404551
K2401028 Certificate of Analysis Aug 24, 2022 H404551
A2506299 Certificate of Analysis Aug 24, 2022 H404551

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Chemical and Physical Properties

Sensitivity Hygroscopic
Molecular Weight 343.000 g/mol
XLogP3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 15
Exact Mass 342.28 Da
Monoisotopic Mass 342.28 Da
Topological Polar Surface Area 8.800 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 230.000
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

Citations of This Product

How to Cite Aladdin Scientific Products?
1. Ao Li, Hongyan Song, Hong Meng, Yingzhou Lu, Chunxi Li.  (2020)  Ultrafast desulfurization of diesel oil with ionic liquid based PMoO catalysts and recyclable NaClO oxidant.  CHEMICAL ENGINEERING JOURNAL,  380  (122453). 

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