2-(Allylthio)nicotinic acid - ≥98% , CAS No.175135-25-8

CAS: 175135-25-8 Cat. No.: A305188 Molecular Weight: 195.24 EC Number: 681-395-2
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
HMS2435A03 | SMR000031317 | AKOS000188793 | MLS000095769 | W-206087 | Maybridge1_001317 | CCG-200044 | 2-(prop-2-en-1-ylsulfanyl)pyridine-3-carboxylic acid | SCHEMBL5226592 | STR06487 | MFCD00051681 | Oprea1_345398 | HMS545D19 | 2-(allylthio)nicotinic aci
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1g
A305188-1g
3
$58.90
5g
A305188-5g
2
$238.90
Enter a quantity for the sizes you want to add.
🧪

Why this grade

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

🌡

Storage & shipping

Room temperature Ships Normal 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
HMS2435A03 | SMR000031317 | AKOS000188793 | MLS000095769 | W-206087 | Maybridge1_001317 | CCG-200044 | 2-(prop-2-en-1-ylsulfanyl)pyridine-3-carboxylic acid | SCHEMBL5226592 | STR06487 | MFCD00051681 | Oprea1_345398 | HMS545D19 | 2-(allylthio)nicotinic aci
Specifications & Purity
≥98%
Storage
Room temperature
Shipped In
Normal
Purity
≥98%
Names and Identifiers
Pubchem Sid488192010
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488192010
Canonical SmilesC=CCSC1=C(C=CC=N1)C(=O)O
IUPAC Name2-prop-2-enylsulfanylpyridine-3-carboxylic acid
InChIKeyKSBMXXMQUGZNSF-UHFFFAOYSA-N
INCHI1S/C9H9NO2S/c1-2-6-13-8-7(9(11)12)4-3-5-10-8/h2-5H,1,6H2,(H,11,12)
Isomeric SMILES C=CCSC1=C(C=CC=N1)C(=O)O
Molecular Weight 195.24
Reaxy-Rn 32303497
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=32303497&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
SubclassPyridinecarboxylic acids and derivatives
Intermediate Tree Nodes Not available
Direct ParentPyridinecarboxylic acids
Alternative Parents Alkylarylthioethers  Vinylogous thioesters  Heteroaromatic compounds  Allyl sulfur compounds  Sulfenyl compounds  Monocarboxylic acids and derivatives  Carboxylic acids  Azacyclic compounds  Organopnictogen compounds  Organooxygen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Pyridine carboxylic acid - Aryl thioether - Alkylarylthioether - Vinylogous thioester - Heteroaromatic compound - Allyl sulfur compound - Azacycle - Sulfenyl compound - Thioether - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as pyridinecarboxylic acids. These are compounds containing a pyridine ring bearing a carboxylic acid group.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
POLI Tchem DNA polymerase iota (116820 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
APEX1 Tchem DNA-(apurinic or apyrimidinic site) lyase (38016 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ATAD5 Tbio ATPase family AAA domain-containing protein 5 (122566 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
ampC Beta-lactamase AmpC (62480 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Plasmodium falciparum (966862 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
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
B2304288Certificate of AnalysisNov 10, 2025 A305188
B2304301Certificate of AnalysisOct 30, 2025 A305188
C2528104Certificate of AnalysisDec 08, 2022 A305188
G2419051Certificate of AnalysisDec 08, 2022 A305188
Chemical and Physical Properties
Refractive Index1.605
Melt Point(°C)147-149°C
Molecular Weight195.240 g/mol
XLogP31.900
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass195.035 Da
Monoisotopic Mass195.035 Da
Topological Polar Surface Area75.500 Ų
Heavy Atom Count13
Formal Charge0
Complexity196.000
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
Reviews

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