1,2-dihydrospiro[indole-3,4'-piperidine]-2-one; trifluoroacetic acid - ≥97% , CAS No.1956371-16-6

CAS: 1956371-16-6 Cat. No.: D637872 Molecular Weight: 316.28 PubChem CID: 86346453

GRADE & PURITY ≥97%

Synonyms

1956371-16-6 | SCHEMBL22587866 | 1,2-Dihydrospiro[indole-3,4'-piperidine]-2-one; trifluoroacetic acid | SB10716 | 1,2-Dihydrospiro[indole-3,4'-piperidine]-2-one TFA | PS-15375 | Spiro[indoline-3,4'-piperidin]-2-one 2,2,2-trifluoroacetate | OQAGVXCHYOJYTB-

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

1956371-16-6 | SCHEMBL22587866 | 1, 2-Dihydrospiro[indole-3, 4'-piperidine]-2-one; trifluoroacetic acid | SB10716 | 1, 2-Dihydrospiro[indole-3, 4'-piperidine]-2-one TFA | PS-15375 | Spiro[indoline-3, 4'-piperidin]-2-one 2, 2, 2-trifluoroacetate | OQAGVXCHYOJYTB-

Specifications & Purity

≥97%

Storage

Room temperature

Shipped In

Normal

Purity

≥97%

Names and Identifiers

• Canonical Smiles: C1CNCCC12C3=CC=CC=C3NC2=O.C(=O)(C(F)(F)F)O
• IUPAC Name: spiro[1H-indole-3,4'-piperidine]-2-one;2,2,2-trifluoroacetic acid
• InChIKey: OQAGVXCHYOJYTB-UHFFFAOYSA-N
• INCHI: 1S/C12H14N2O.C2HF3O2/c15-11-12(5-7-13-8-6-12)9-3-1-2-4-10(9)14-11;3-2(4,5)1(6)7/h1-4,13H,5-8H2,(H,14,15);(H,6,7)
• Isomeric SMILES: C1CNCCC12C3=CC=CC=C3NC2=O.C(=O)(C(F)(F)F)O
• Alternate CAS: 1956371-16-6
• PubChem CID: 86346453
• Molecular Weight: 316.28

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Indoles and derivatives
      • Subclass Indolines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Indoles and derivatives
• Subclass: Indolines
• Intermediate Tree Nodes: Not available
• Direct Parent: Indolines
• Alternative Parents: Aralkylamines Piperidines Benzenoids Alpha-halocarboxylic acids Secondary carboxylic acid amides Amino acids and derivatives Lactams Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Dialkylamines Organofluorides Hydrocarbon derivatives Carbonyl compounds Organic oxides Alkyl fluorides
• Molecular Framework: Not available
• Substituents: Dihydroindole - Aralkylamine - Benzenoid - Piperidine - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Lactam - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Azacycle - Secondary amine - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Carbonyl group - Amine - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as indolines. These are compounds containing an indole moiety, which consists of pyrrolidine ring fused to benzene to form 2,3-dihydroindole.
• 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