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· · COA & SDS available for every product · Same-day shipping on in-stock items 1-(2,2,2-trifluoroethyl)azetidine-3-carboxylic acid - ≥97% , CAS No.1339115-53-5
Synonyms
1339115-53-5 | MFCD20282477 | A1-06905 | AS-78896 | AKOS013581876 | 1-(2,2,2-trifluoroethyl)azetidine-3-carboxylic acid | D79217 | F8880-6836 | SY155930 | SCHEMBL20161465 | 1-(2,2,2-trifluoroethyl)azetidine-3-carboxylicacid | JNYQZTQYRYZPSA-UHFFFAOYSA-N |
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Why this grade ≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature 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
1339115-53-5 | MFCD20282477 | A1-06905 | AS-78896 | AKOS013581876 | 1-(2, 2, 2-trifluoroethyl)azetidine-3-carboxylic acid | D79217 | F8880-6836 | SY155930 | SCHEMBL20161465 | 1-(2, 2, 2-trifluoroethyl)azetidine-3-carboxylicacid | JNYQZTQYRYZPSA-UHFFFAOYSA-N |
Specifications & Purity
≥97%
Names and Identifiers Canonical Smiles C1C(CN1CC(F)(F)F)C(=O)O IUPAC Name 1-(2,2,2-trifluoroethyl)azetidine-3-carboxylic acid InChIKey JNYQZTQYRYZPSA-UHFFFAOYSA-N INCHI 1S/C6H8F3NO2/c7-6(8,9)3-10-1-4(2-10)5(11)12/h4H,1-3H2,(H,11,12) Isomeric SMILES C1C(CN1CC(F)(F)F)C(=O)O Alternate CAS 1339115-53-5 PubChem CID 64260693 Molecular Weight 183.13
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 Kingdom Organic compounds Superclass Organoheterocyclic compounds Class Azetidines Subclass Azetidinecarboxylic acids or derivatives Intermediate Tree Nodes Not available Direct Parent Azetidinecarboxylic acids Alternative Parents Trialkylamines Amino acids Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides Molecular Framework Aliphatic heteromonocyclic compounds Substituents Azetidinecarboxylic acid - Amino acid or derivatives - Tertiary amine - Amino acid - Tertiary aliphatic amine - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Azacycle - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Amine - Aliphatic heteromonocyclic compound Description This compound belongs to the class of organic compounds known as azetidinecarboxylic acids. These are organic compounds containing a carboxylic acid group attached to an azetidine 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 Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Molecular Weight 183.130 g/mol XLogP3 -1.600 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 6 Rotatable Bond Count 2 Exact Mass 183.051 Da Monoisotopic Mass 183.051 Da Topological Polar Surface Area 40.500 Ų Heavy Atom Count 12 Formal Charge 0 Complexity 186.000 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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