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Bromoacetylcholine bromide , CAS No.22004-27-9

COA COA
    Grade & Purity:
  • ≥97%
In stock
Item Number
B353648
Grouped product items
SKU Size
Availability
 Price Qty
B353648-100mg
100mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$131.90
B353648-500mg
500mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$459.90
Wish List
Bulk Order  SDS  DATASHEET  Specification Sheet

an affinity alkylating agent for nicotinic receptors

View related series
Fatty chain compounds (194)

Basic Description

Synonyms DTXSID701017386 | LP00196 | B-121 | HMS3260H13 | EU-0100196 | J-014415 | SR-01000075729-1 | {2-[(2-bromoacetyl)oxy]ethyl}trimethylazanium bromide | D86709 | WS-00565 | MLS002153520 | Tox21_500196 | 2-(2-Bromoacetyloxy)-N.,N,N-trimethylethanaminium bromide
Specifications & Purity ≥97%
Storage Temp Store at -20°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Product Description

Bromoacetylcholine bromide is used as an affinity alkylating agent for nicotinic receptors.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Organic nitrogen compounds
Class Organonitrogen compounds
Subclass Quaternary ammonium salts
Intermediate Tree Nodes Cholines
Direct Parent Acyl cholines
Alternative Parents Tetraalkylammonium salts  Alpha-halocarboxylic acid derivatives  Carboxylic acid esters  Monocarboxylic acids and derivatives  Organobromides  Organic oxides  Organic bromide salts  Hydrocarbon derivatives  Carbonyl compounds  Amines  Alkyl bromides  Organic cations  
Molecular Framework Aliphatic acyclic compounds
Substituents Acyl choline - Alpha-halocarboxylic acid derivative - Tetraalkylammonium salt - Alpha-halocarboxylic acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organooxygen compound - Organobromide - Organohalogen compound - Organic bromide salt - Organic oxygen compound - Carbonyl group - Amine - Hydrocarbon derivative - Organic oxide - Alkyl halide - Alkyl bromide - Organic salt - Organic cation - Aliphatic acyclic compound
Description This compound belongs to the class of organic compounds known as acyl cholines. These are acylated derivatives of choline. Choline or 2-Hydroxy-N,N,N-trimethylethanaminium is a quaternary ammonium salt with the chemical formula (CH3)3N+(CH2)2OH.
External Descriptors Not available

Associated Targets(Human)

TSHR Tclin Thyroid stimulating hormone receptor (29986 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
SLC5A7 Tchem High-affinity choline transporter (1462 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
POLI Tchem DNA polymerase iota (116820 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
EHMT2 Tchem Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 (93046 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
L3MBTL1 Tchem Lethal(3)malignant brain tumor-like protein 1 (14536 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
GMNN Tbio Geminin (128009 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
MPHOSPH8 Tbio M-phase phosphoprotein 8 (656 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
USP1 Tchem Ubiquitin carboxyl-terminal hydrolase 1 (22556 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Associated Targets(non-human)

Danio rerio (3092 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

IUPAC Name 2-(2-bromoacetyl)oxyethyl-trimethylazanium;bromide
INCHI InChI=1S/C7H15BrNO2.BrH/c1-9(2,3)4-5-11-7(10)6-8;/h4-6H2,1-3H3;1H/q+1;/p-1
InChIKey AFIIOPIEVQSYHH-UHFFFAOYSA-M
Smiles C[N+](C)(C)CCOC(=O)CBr.[Br-]
Isomeric SMILES C[N+](C)(C)CCOC(=O)CBr.[Br-]
WGK Germany 3
RTECS FZ9902000
PubChem CID 11957478
Molecular Weight 305.01

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.

4 results found

Lot Number Certificate Type Date Item
A2517201 Certificate of Analysis Jan 10, 2025 B353648
A2517199 Certificate of Analysis Jan 10, 2025 B353648
A2517202 Certificate of Analysis Jan 10, 2025 B353648
A2517203 Certificate of Analysis Jan 10, 2025 B353648

Chemical and Physical Properties

Solubility H2O: soluble
Melt Point(°C) 135-137° C
Molecular Weight 305.010 g/mol
XLogP3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 5
Exact Mass 304.945 Da
Monoisotopic Mass 302.947 Da
Topological Polar Surface Area 26.300 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 131.000
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

Solution Calculators

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