3-Methylpyridine-2(1H)-thione - ≥98% , CAS No.18368-66-6

CAS: 18368-66-6 Cat. No.: M404770 Molecular Weight: 125.19 EC Number: 806-134-3
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
3-methyl-1H-pyridine-2-thione | DTXSID20418688 | OXDOMAKPLZVHCE-UHFFFAOYSA- | SB53184 | 3-methyl-1,2-dihydropyridine-2-thione | methylpyridine-2-thione | InChI=1/C6H7NS/c1-5-3-2-4-7-6(5)8/h2-4H,1H3,(H,7,8) | 3-Methyl-2(1H)-pyridinethione | 2(1H)-Pyridinet
Storage
Argon charged,Room temperature
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
250mg
M404770-250mg
4
$59.90
1g
M404770-1g
5
$174.90
Enter a quantity for the sizes you want to add.
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Why this grade

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

🌡

Storage & shipping

Argon charged,Room temperature Ships Check lot-specific COA for exact specifications.

📋

Quality documents

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

📚

Literature proof

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

Specifications

Synonyms
3-methyl-1H-pyridine-2-thione | DTXSID20418688 | OXDOMAKPLZVHCE-UHFFFAOYSA- | SB53184 | 3-methyl-1, 2-dihydropyridine-2-thione | methylpyridine-2-thione | InChI=1/C6H7NS/c1-5-3-2-4-7-6(5)8/h2-4H, 1H3, (H, 7, 8) | 3-Methyl-2(1H)-pyridinethione | 2(1H)-Pyridinet
Specifications & Purity
≥98%
Storage
Argon charged, Room temperature
Purity
≥98%
Names and Identifiers
Pubchem Sid504763776
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504763776
Canonical SmilesCC1=CC=CNC1=S
IUPAC Name3-methyl-1H-pyridine-2-thione
InChIKeyOXDOMAKPLZVHCE-UHFFFAOYSA-N
INCHI1S/C6H7NS/c1-5-3-2-4-7-6(5)8/h2-4H,1H3,(H,7,8)
Isomeric SMILES CC1=CC=CNC1=S
Molecular Weight 125.19
Reaxy-Rn 1523986
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1523986&ln=

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
SuperclassOrganoheterocyclic compounds
ClassPyridines and derivatives
SubclassMethylpyridines
Intermediate Tree Nodes Not available
Direct ParentMethylpyridines
Alternative Parents Dihydropyridines  Thiolactams  Heteroaromatic compounds  Azacyclic compounds  Organosulfur compounds  Organonitrogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Methylpyridine - Dihydropyridine - Hydropyridine - Heteroaromatic compound - Thiolactam - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as methylpyridines. These are organic compounds containing a pyridine ring substituted at one or more positions by a methyl 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:

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

4 results found

Lot NumberCertificate TypeDateItem
F2317187Certificate of AnalysisApr 02, 2026 M404770
F2317195Certificate of AnalysisApr 02, 2026 M404770
F2317196Certificate of AnalysisApr 02, 2026 M404770
F2317204Certificate of AnalysisApr 02, 2026 M404770
Chemical and Physical Properties
SensitivityAir Sensitive
Melt Point(°C)172 °C
Molecular Weight125.190 g/mol
XLogP31.200
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass125.03 Da
Monoisotopic Mass125.03 Da
Topological Polar Surface Area44.100 Ų
Heavy Atom Count8
Formal Charge0
Complexity167.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
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