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· · COA & SDS available for every product · Same-day shipping on in-stock items 2-methyl-3a,4,5,6,7,7a-hexahydro-1H-pyrrolo[3,4-c]pyridin-3-one - ≥97% , CAS No.1242336-75-9
Synonyms
2-Methylhexahydro-1H-pyrrolo[3,4-c]pyridin-3(2H)-one | P20801 | 1242336-75-9 | SY323034 | AS-79504 | MFCD24506310 | SB10539 | Octahydro-2-methyl-3H-pyrrolo[3,4-c]pyridin-3-one | 2-Methyloctahydro-3H-pyrrolo[3,4-c]pyridin-3-one | PB18223 | SB20007 | 2-meth
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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
2-Methylhexahydro-1H-pyrrolo[3, 4-c]pyridin-3(2H)-one | P20801 | 1242336-75-9 | SY323034 | AS-79504 | MFCD24506310 | SB10539 | Octahydro-2-methyl-3H-pyrrolo[3, 4-c]pyridin-3-one | 2-Methyloctahydro-3H-pyrrolo[3, 4-c]pyridin-3-one | PB18223 | SB20007 | 2-meth
Specifications & Purity
≥97%
Names and Identifiers Canonical Smiles CN1CC2CCNCC2C1=O IUPAC Name 2-methyl-3a,4,5,6,7,7a-hexahydro-1H-pyrrolo[3,4-c]pyridin-3-one InChIKey BVBFTJUIOLVKRS-UHFFFAOYSA-N INCHI 1S/C8H14N2O/c1-10-5-6-2-3-9-4-7(6)8(10)11/h6-7,9H,2-5H2,1H3 Isomeric SMILES CN1CC2CCNCC2C1=O Alternate CAS 1242336-75-9 Molecular Weight 154.21 Reaxy-Rn 62376154 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=62376154&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 Organic acids and derivatives Class Carboxylic acids and derivatives Subclass Amino acids, peptides, and analogues Intermediate Tree Nodes Amino acids and derivatives Direct Parent Beta amino acids and derivatives Alternative Parents Pyrrolopyridines Piperidinecarboxamides Pyrrolidine-2-ones Pyridines and derivatives N-alkylpyrrolidines N-acyl amines Tertiary carboxylic acid amides Lactams Dialkylamines Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aliphatic heteropolycyclic compounds Substituents Beta amino acid or derivatives - Pyrrolopyridine - Piperidinecarboxamide - 3-piperidinecarboxamide - N-alkylpyrrolidine - 2-pyrrolidone - Pyrrolidone - Pyridine - Piperidine - N-acyl-amine - Tertiary carboxylic acid amide - Pyrrolidine - Lactam - Carboxamide group - Azacycle - Organoheterocyclic compound - Secondary amine - Secondary aliphatic amine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Amine - Aliphatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom. 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 154.210 g/mol XLogP3 -0.600 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 0 Exact Mass 154.111 Da Monoisotopic Mass 154.111 Da Topological Polar Surface Area 32.299 Ų Heavy Atom Count 11 Formal Charge 0 Complexity 181.000 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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