A 85380 dihydrochloride - ≥98%(HPLC) , CAS No.174740-86-4

CAS: 174740-86-4 Cat. No.: A286780 Molecular Weight: 237.13 PubChem CID: 10399247
AVAILABLE TO ORDER
GRADE & PURITY ≥98%(HPLC)
Synonyms
3-[(2S)-2-Azetidinylmethoxy]-pyridine dihydrochloride
Storage
Room temperature,Desiccated
Shipped In
Normal
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Size
Status
Price
Qty
10mg
A286780-10mg
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$447.90
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Why this grade

≥98%(HPLC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature,Desiccated Ships Normal Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
3-[(2S)-2-Azetidinylmethoxy]-pyridine dihydrochloride
Specifications & Purity
≥98%(HPLC)
Biochemical and Physiological Mechanisms
High affinity and selectiveα4β2 nACh receptor agonist (Kivalues are 0.05, 148 and 314 nM forα4β2, α7 andα1β1δγreceptors respectively). Stimulates cation efflux in K177 cells expressingα4β2.
Storage
Room temperature, Desiccated
Shipped In
Normal
Action Type
AGONIST
Purity
≥98%(HPLC)
Names and Identifiers
Canonical SmilesC1CNC1COC2=CN=CC=C2.Cl.Cl
IUPAC Name3-[[(2S)-azetidin-2-yl]methoxy]pyridine;dihydrochloride
InChIKeyGVEVDINKRFDXFP-JZGIKJSDSA-N
INCHI1S/C9H12N2O.2ClH/c1-2-9(6-10-4-1)12-7-8-3-5-11-8;;/h1-2,4,6,8,11H,3,5,7H2;2*1H/t8-;;/m0../s1
Isomeric SMILES C1CN[C@@H]1COC2=CN=CC=C2.Cl.Cl
PubChem CID 10399247
Molecular Weight 237.13

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganic oxygen compounds
ClassOrganooxygen compounds
SubclassEthers
Intermediate Tree Nodes Not available
Direct ParentAlkyl aryl ethers
Alternative Parents Pyridines and derivatives  Heteroaromatic compounds  Azetidines  Dialkylamines  Azacyclic compounds  Hydrochlorides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Alkyl aryl ether - Pyridine - Heteroaromatic compound - Azetidine - Azacycle - Organoheterocyclic compound - Secondary amine - Secondary aliphatic amine - Organic nitrogen compound - Hydrocarbon derivative - Hydrochloride - Organonitrogen compound - Amine - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as alkyl aryl ethers. These are organic compounds containing the alkyl aryl ether functional group with the generic formula R-O-R' , where R is an alkyl group and R' is an aryl group.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
SolubilitySolvent:water, Max Conc. mg/mL: 23.71, Max Conc. mM: 100; Solvent:DMSO, Max Conc. mg/mL: 23.71, Max Conc. mM: 100
Molecular Weight237.120 g/mol
XLogP3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass236.048 Da
Monoisotopic Mass236.048 Da
Topological Polar Surface Area34.200 Ų
Heavy Atom Count14
Formal Charge0
Complexity140.000
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count3
Solution Calculators
Reviews

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