5-Fluoroindoline - ≥97% , CAS No.2343-22-8

CAS: 2343-22-8 Cat. No.: F124808 Peso molecular: 137.16 Número EC: 671-183-8

GRADE & PURITY ≥97%

Synonyms

5-fluoroindoline|2343-22-8|5-fluoro-2,3-dihydro-1H-indole|5-FLUORO-2,3-DIHYDRO-(1H)-INDOLE|1H-Indole, 5-fluoro-2,3-dihydro-|5-Fluoro-2,3-dihydroindole|MFCD00214461|5-fluoro-indoline|2,3-Dihydro-5-fluoro-1H-indole|Peakdale1_000398|5-Fluoroindoline, 97%|SCH

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

5-fluoroindoline | 2343-22-8 | 5-fluoro-2, 3-dihydro-1H-indole | 5-FLUORO-2, 3-DIHYDRO-(1H)-INDOLE | 1H-Indole, 5-fluoro-2, 3-dihydro- | 5-Fluoro-2, 3-dihydroindole | MFCD00214461 | 5-fluoro-indoline | 2, 3-Dihydro-5-fluoro-1H-indole | Peakdale1_000398 | 5-Fluoroindoline, 97% | SCH

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Argon charged

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥97%

Nombres e identificadores

• Sonrisas canónicas: C1CNC2=C1C=C(C=C2)F
• IUPAC Name: 5-fluoro-2,3-dihydro-1H-indole
• InChIKey: NXQRMQIYCWFDGP-UHFFFAOYSA-N
• INCHI: 1S/C8H8FN/c9-7-1-2-8-6(5-7)3-4-10-8/h1-2,5,10H,3-4H2
• Isómeros SMILES: C1CNC2=C1C=C(C=C2)F
• Peso molecular: 137.16
• Reaxy-Rn: 1424138
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1424138&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Indoles and derivatives
• Subclass: Indolines
• Intermediate Tree Nodes: Not available
• Direct Parent: Indolines
• Alternative Parents: Secondary alkylarylamines Aralkylamines Benzenoids Aryl fluorides Azacyclic compounds Organopnictogen compounds Organofluorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Dihydroindole - Secondary aliphatic/aromatic amine - Aralkylamine - Benzenoid - Aryl halide - Aryl fluoride - Azacycle - Secondary amine - Amine - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Aromatic heteropolycyclic compound
• Descripción: 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

Propiedades químicas y físicas

• Sensibilidad: air ＆light ＆Moisture sensitive
• Peso molecular: 137.150 g/mol
• XLogP3: 2.300
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 137.064 Da
• Monoisotopic Mass: 137.064 Da
• Topological Polar Surface Area: 12.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 126.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1