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Metabolites & Degradation Products

N-Desmethyl Xanomeline

Reference StandardAvailable on request

N-Desmethyl Xanomeline (CAS 131986-96-4) supplier Zemixal: C13H21N3OS, COA and SDS with every lot, worldwide shipping. Packs from 10 mg.

Pack sizes
N-Desmethyl Xanomeline chemical structure
CAS number131986-96-4
FormulaC13H21N3OS
Molar mass267.39 g/mol
Physical formSolid
HS code38229090
InChIKeyCSFYOLMLLRWDAE-UHFFFAOYSA-N
IUPAC name3-hexoxy-4-(1,2,3,6-tetrahydropyridin-5-yl)-1,2,5-thiadiazole

About N-Desmethyl Xanomeline

Zemixal lists N-Desmethyl Xanomeline for laboratories that identify, quantify or control Xanomeline and its related substances. Identity at a glance (Reference Standard): CAS 131986-96-4, formula C13H21N3OS and molar mass 267.39 g/mol. It is handled as a solid.

Common uses in the lab and plant

  • Metabolite identification
  • Stability-indicating methods
  • Impurity profiling

Storage and safety notes

Classified under GHS with signal word Danger and hazard statements H302, H315, H318 and H335. Read the SDS before first use.

Order it in 10 mg, 25 mg, 50 mg and 100 mg packs or ask for a bulk quotation. You receive a certificate of analysis with characterisation data with each order. Send an enquiry through the quote panel and you get a formal offer with Incoterms and delivery time.

Reference standards for Xanomeline

See every impurity, metabolite and related compound we list for this API.

Xanomeline standards

Typical uses

  • Metabolite identification
  • Stability-indicating methods
  • Impurity profiling

Applications

Pharmaceutical Manufacturing and QCResearch Labs and Universities

Specifications and identifiers

Specifications of N-Desmethyl Xanomeline
Product nameN-Desmethyl Xanomeline
Catalogue numberZX-032776
CAS number131986-96-4
IUPAC name3-hexoxy-4-(1,2,3,6-tetrahydropyridin-5-yl)-1,2,5-thiadiazole
Molecular formulaC13H21N3OS
Molar mass267.39 g/mol
Exact mass267.1405
GradeReference Standard
Physical formSolid
XLogP32.8
H-bond donors / acceptors1 / 5
Topological polar surface area75.3 Ų
HS code38229090
InChIKeyCSFYOLMLLRWDAE-UHFFFAOYSA-N
SMILESCCCCCCOC1=NSN=C1C2=CCCNC2
PubChem CID11777765
Synonyms5-[4-(hexyloxy)-1,2,5-thiadiazol-3-yl]-1,2,3,6-tetrahydropyridine, 5-(4-(Hexyloxy)-1,2,5-thiadiazol-3-yl)-1,2,3,6-tetrahydropyridine, 3-(Hexyloxy)-4-(1,2,5,6-tetrahydropyridin-3-yl)-1,2,5-thiadiazole, 3-[4-(Hexyloxy)-1,2,5-thiadiazol-3-yl]-1,2,5,6-tetrahydropyridine, Pyridine, 3-[4-(hexyloxy)-1,2,5-thiadiazol-3-yl]-1,2,5,6-tetrahydro-

Lot values are stated on the batch certificate of analysis. Ask for a typical COA with your quotation.

Safety and GHS hazards

GHS05 Corrosive
Corrosive
GHS07 Irritant or harmful
Irritant or harmful

Signal word Danger

  • H302Harmful if swallowed
  • H315Causes skin irritation
  • H318Causes serious eye damage
  • H335May cause respiratory irritation

Precautionary statements P261, P264, P264 + P265, P270, P271, P280, P301 + P317, P302 + P352, P304 + P340, P305 + P354 + P338, P317, P319, P321, P330, P332 + P317, P362 + P364, P403 + P233, P405, P501

Classification summarised from public GHS notifications. It can vary with grade and concentration, so always follow the SDS supplied with your lot.

Pack sizes

Pack sizes of N-Desmethyl Xanomeline
10 mgQuoted on request
25 mgQuoted on request
50 mgQuoted on request
100 mgQuoted on request

Need a different size? Bulk drums and custom packing are quoted on request through the quote form on this page.

Questions about N-Desmethyl Xanomeline

Which CAS number identifies N-Desmethyl Xanomeline?
N-Desmethyl Xanomeline is registered under CAS 131986-96-4. You may also see it listed as 5-[4-(hexyloxy)-1,2,5-thiadiazol-3-yl]-1,2,3,6-tetrahydropyridine, 5-(4-(Hexyloxy)-1,2,5-thiadiazol-3-yl)-1,2,3,6-tetrahydropyridine, 3-(Hexyloxy)-4-(1,2,5,6-tetrahydropyridin-3-yl)-1,2,5-thiadiazole. Our catalogue number for this item is ZX-032776.
What are the formula and molar mass of N-Desmethyl Xanomeline?
For N-Desmethyl Xanomeline, its formula is C13H21N3OS and its molar mass is 267.39 g/mol. The systematic (IUPAC) name is 3-hexoxy-4-(1,2,3,6-tetrahydropyridin-5-yl)-1,2,5-thiadiazole. InChIKey CSFYOLMLLRWDAE-UHFFFAOYSA-N lets you match it in any structure database.
How is N-Desmethyl Xanomeline used in pharmaceutical QC?
N-Desmethyl Xanomeline is a characterised reference material linked to Xanomeline. Laboratories use it to identify and quantify this impurity during method development and validation, stability work, batch release testing and regulatory submissions.
What grade and pack sizes are available for N-Desmethyl Xanomeline?
This listing is Reference Standard grade. Standard packs are 10 mg, 25 mg, 50 mg, 100 mg. Larger quantities and custom packing can be quoted on request.
Which documents come with N-Desmethyl Xanomeline?
Each lot ships with a batch certificate of analysis and a 16-section GHS safety data sheet. A typical COA or specification sheet can be shared with the quotation before you order.
Can Zemixal ship N-Desmethyl Xanomeline to my country?
Yes. Because N-Desmethyl Xanomeline is classed as hazardous, it travels in UN-approved packaging as dangerous goods under IATA or IMDG rules, with the export paperwork your broker needs.

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