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· · COA & SDS available for every product · Same-day shipping on in-stock items 8-boc-2-oxo-8-azabicyclo[3.2.1]octane - ≥97% , CAS No.1408076-39-0
Synonyms
AS-51768 | P19425 | AKOS022930341 | 8-Azabicyclo[3.2.1]octane-8-carboxylic acid, 2-oxo-, 1,1-dimethylethyl ester | SCHEMBL21588272 | 1408076-39-0 | MFCD23105912 | 8-Boc-2-oxo-8-azabicyclo[3.2.1]octane | EN300-702976 | SB20542 | (1R,5S)-8-Boc-8-azabicyclo[
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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
AS-51768 | P19425 | AKOS022930341 | 8-Azabicyclo[3.2.1]octane-8-carboxylic acid, 2-oxo-, 1, 1-dimethylethyl ester | SCHEMBL21588272 | 1408076-39-0 | MFCD23105912 | 8-Boc-2-oxo-8-azabicyclo[3.2.1]octane | EN300-702976 | SB20542 | (1R, 5S)-8-Boc-8-azabicyclo[
Specifications & Purity
≥97%
Names and Identifiers Canonical Smiles CC(C)(C)OC(=O)N1C2CCC1C(=O)CC2 IUPAC Name tert-butyl 2-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate InChIKey SJGXXUBCKFNNGB-UHFFFAOYSA-N INCHI 1S/C12H19NO3/c1-12(2,3)16-11(15)13-8-4-6-9(13)10(14)7-5-8/h8-9H,4-7H2,1-3H3 Isomeric SMILES CC(C)(C)OC(=O)N1C2CCC1C(=O)CC2 Molecular Weight 225.288 Reaxy-Rn 32406214 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=32406214&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 Kingdom Organic compounds Superclass Alkaloids and derivatives Class Tropane alkaloids Subclass Not available Intermediate Tree Nodes Not available Direct Parent Tropane alkaloids Alternative Parents Piperidinecarboxylic acids Pyrrolidine carboxylic acids Piperidinones Carbamate esters Ketones Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aliphatic heteropolycyclic compounds Substituents Piperidinecarboxylic acid - Tropane alkaloid - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Piperidinone - Piperidine - Carbamic acid ester - Pyrrolidine - Ketone - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Aliphatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as tropane alkaloids. These are organic compounds containing the nitrogenous bicyclic alkaloid parent N-Methyl-8-azabicyclo[3.2.1]octane. 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 225.280 g/mol XLogP3 1.600 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 2 Exact Mass 225.136 Da Monoisotopic Mass 225.136 Da Topological Polar Surface Area 46.600 Ų Heavy Atom Count 16 Formal Charge 0 Complexity 319.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 2 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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