1-tert-butyl 3-methyl 1,4,5,6-tetrahydropyridine-1,3-dicarboxylate - ≥97% , CAS No.1293370-64-5

CAS: 1293370-64-5 Cat. No.: T628144 Molecular Weight: 241.29 PubChem CID: 83678753

GRADE & PURITY ≥97%

Synonyms

1293370-64-5 | 1-tert-butyl 3-methyl 1,4,5,6-tetrahydropyridine-1,3-dicarboxylate | 1-O-tert-butyl 5-O-methyl 3,4-dihydro-2H-pyridine-1,5-dicarboxylate | MFCD30803986 | SB23197 | BS-43298 | D79693 | 3-Methyl 1-boc-1,4,5,6-tetrahydropyridine-3-carboxylate

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

1293370-64-5 | 1-tert-butyl 3-methyl 1, 4, 5, 6-tetrahydropyridine-1, 3-dicarboxylate | 1-O-tert-butyl 5-O-methyl 3, 4-dihydro-2H-pyridine-1, 5-dicarboxylate | MFCD30803986 | SB23197 | BS-43298 | D79693 | 3-Methyl 1-boc-1, 4, 5, 6-tetrahydropyridine-3-carboxylate

Specifications & Purity

≥97%

Storage

Room temperature

Shipped In

Normal

Purity

≥97%

Names and Identifiers

• Canonical Smiles: CC(C)(C)OC(=O)N1CCCC(=C1)C(=O)OC
• IUPAC Name: 1-O-tert-butyl 5-O-methyl 3,4-dihydro-2H-pyridine-1,5-dicarboxylate
• InChIKey: WRFDLNYBZIBNCC-UHFFFAOYSA-N
• INCHI: 1S/C12H19NO4/c1-12(2,3)17-11(15)13-7-5-6-9(8-13)10(14)16-4/h8H,5-7H2,1-4H3
• PubChem CID: 83678753
• Molecular Weight: 241.29

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Pyridines and derivatives
      • Subclass Hydropyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Pyridines and derivatives
• Subclass: Hydropyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: Tetrahydropyridines
• Alternative Parents: Vinylogous amides Methyl esters Enoate esters Carbamate esters Monocarboxylic acids and derivatives Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Tetrahydropyridine - Carbamic acid ester - Methyl ester - Enoate ester - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Aliphatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as tetrahydropyridines. These are derivatives of pyridine in which two double bonds in the pyridine moiety are reduced by adding four hydrogen atoms.
• 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.

DOI: 10.1186/s13321-016-0174-y