ethyl 5-azaspiro[2.3]hexane-2-carboxylate;2,2,2-trifluoroacetic acid - ≥97% , CAS No.2567497-71-4

CAS: 2567497-71-4 Cat. No.: E638045 EC Number: 877-722-5 PubChem CID: 155820305

GRADE & PURITY ≥97%

Synonyms

2567497-71-4 | F86122 | ETHYL 5-AZASPIRO[2.3]HEXANE-1-CARBOXYLATE TRIFLUOROACETIC ACID | PS-18919 | EN300-27694550 | Ethyl 5-azaspiro[2.3]hexane-2-carboxylate;2,2,2-trifluoroacetic acid | ethyl 5-azaspiro[2.3]hexane-1-carboxylate; trifluoroacetic acid | E

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Synonyms

2567497-71-4 | F86122 | ETHYL 5-AZASPIRO[2.3]HEXANE-1-CARBOXYLATE TRIFLUOROACETIC ACID | PS-18919 | EN300-27694550 | Ethyl 5-azaspiro[2.3]hexane-2-carboxylate;2, 2, 2-trifluoroacetic acid | ethyl 5-azaspiro[2.3]hexane-1-carboxylate; trifluoroacetic acid | E

Specifications & Purity

≥97%

Storage

Store at 2-8°C

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥97%

Names and Identifiers

• Canonical Smiles: CCOC(=O)C1CC12CNC2.C(=O)(C(F)(F)F)O
• IUPAC Name: ethyl 5-azaspiro[2.3]hexane-2-carboxylate;2,2,2-trifluoroacetic acid
• InChIKey: QHPMIENLAHQVJG-UHFFFAOYSA-N
• INCHI: 1S/C8H13NO2.C2HF3O2/c1-2-11-7(10)6-3-8(6)4-9-5-8;3-2(4,5)1(6)7/h6,9H,2-5H2,1H3;(H,6,7)
• Isomeric SMILES: CCOC(=O)C1CC12CNC2.C(=O)(C(F)(F)F)O
• Alternate CAS: 2567497-71-4
• PubChem CID: 155820305

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Carboxylic acids and derivatives
      • Subclass Cyclopropanecarboxylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Cyclopropanecarboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Cyclopropanecarboxylic acids and derivatives
• Alternative Parents: Alpha-halocarboxylic acids Carboxylic acid esters Azetidines Amino acids and derivatives Monocarboxylic acids and derivatives Dialkylamines Carboxylic acids Azacyclic compounds Organopnictogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
• Molecular Framework: Not available
• Substituents: Cyclopropanecarboxylic acid or derivatives - Alpha-halocarboxylic acid or derivatives - Alpha-halocarboxylic acid - Carboxylic acid ester - Azetidine - Amino acid or derivatives - Azacycle - Organoheterocyclic compound - Secondary amine - Monocarboxylic acid or derivatives - Secondary aliphatic amine - Carboxylic acid - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Carbonyl group - Amine - Alkyl halide - Alkyl fluoride - Aliphatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as cyclopropanecarboxylic acids and derivatives. These are organic compounds containing a carboxyl group (or a derivative thereof) attached to a cyclopropane 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.

DOI: 10.1186/s13321-016-0174-y