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· · COA & SDS available for every product · Same-day shipping on in-stock items 3-(2-Methylquinazolin-4-yl)sulfanylpropanoic acid , CAS No.310421-94-4
Synonyms
3-(2-methylquinazolin-4-yl)sulfanylpropanoic acid | SMR000108535 | MLS000112624 | 3-((2-Methylquinazolin-4-yl)thio)propanoic acid | 3-[(2-methylquinazolin-4-yl)sulfanyl]propanoic acid | SR-01000485799 | 3-(2-methylquinazolin-4-ylthio)propanoic acid | Camb
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Why this grade for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships 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-(2-methylquinazolin-4-yl)sulfanylpropanoic acid | SMR000108535 | MLS000112624 | 3-((2-Methylquinazolin-4-yl)thio)propanoic acid | 3-[(2-methylquinazolin-4-yl)sulfanyl]propanoic acid | SR-01000485799 | 3-(2-methylquinazolin-4-ylthio)propanoic acid | Camb
Product Properties Names and Identifiers Canonical Smiles CC1=NC2=CC=CC=C2C(=N1)SCCC(=O)O IUPAC Name 3-(2-methylquinazolin-4-yl)sulfanylpropanoic acid InChIKey BWOVZKBKWYSBAR-UHFFFAOYSA-N INCHI 1S/C12H12N2O2S/c1-8-13-10-5-3-2-4-9(10)12(14-8)17-7-6-11(15)16/h2-5H,6-7H2,1H3,(H,15,16) Isomeric SMILES CC1=NC2=CC=CC=C2C(=N1)SCCC(=O)O PubChem CID 588806 Molecular Weight 248.3
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 Kingdom Organic compounds Superclass Organoheterocyclic compounds Class Diazanaphthalenes Subclass Benzodiazines Intermediate Tree Nodes Not available Direct Parent Quinazolines Alternative Parents Alkylarylthioethers Pyrimidines and pyrimidine derivatives Benzenoids Heteroaromatic compounds Sulfenyl compounds Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aromatic heteropolycyclic compounds Substituents Quinazoline - Aryl thioether - Alkylarylthioether - Pyrimidine - Benzenoid - Heteroaromatic compound - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Azacycle - Sulfenyl compound - Thioether - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as quinazolines. These are compounds containing a quinazoline moiety, which is made up of two fused six-member aromatic rings, a benzene ring and a pyrimidine ring. External Descriptors Not available Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3D Structure Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Molecular Weight 248.300 g/mol XLogP3 2.300 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 5 Rotatable Bond Count 4 Exact Mass 248.062 Da Monoisotopic Mass 248.062 Da Topological Polar Surface Area 88.400 Ų Heavy Atom Count 17 Formal Charge 0 Complexity 275.000 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 1
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