5,7-difluoro-2-(4-fluorophenyl)-1H-indole - ≥97% , CAS No.901188-04-3

CAS: 901188-04-3 Cat. No.: D635038 Molecular Weight: 247.21 EC Number: 871-351-2 PubChem CID: 131886934

GRADE & PURITY ≥97%

Synonyms

PS-19863 | F78308 | 5,7-Difluoro-2-(4-fluorophenyl)indole | 5,7-difluoro-2-(4-fluorophenyl)-1h-indole | SY323805 | SCHEMBL22118349 | MFCD05223284

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

PS-19863 | F78308 | 5, 7-Difluoro-2-(4-fluorophenyl)indole | 5, 7-difluoro-2-(4-fluorophenyl)-1h-indole | SY323805 | SCHEMBL22118349 | MFCD05223284

Specifications & Purity

≥97%

Storage

Room temperature

Shipped In

Normal

Purity

≥97%

Names and Identifiers

• Canonical Smiles: C1=CC(=CC=C1C2=CC3=CC(=CC(=C3N2)F)F)F
• IUPAC Name: 5,7-difluoro-2-(4-fluorophenyl)-1H-indole
• InChIKey: HYMAELHWXZVYTK-UHFFFAOYSA-N
• INCHI: 1S/C14H8F3N/c15-10-3-1-8(2-4-10)13-6-9-5-11(16)7-12(17)14(9)18-13/h1-7,18H
• Isomeric SMILES: C1=CC(=CC=C1C2=CC3=CC(=CC(=C3N2)F)F)F
• Alternate CAS: 901188-04-3
• PubChem CID: 131886934
• Molecular Weight: 247.21

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Indoles and derivatives
• Subclass: Indoles
• Intermediate Tree Nodes: Not available
• Direct Parent: Indoles
• Alternative Parents: Fluorobenzenes Pyrrolines Pyrroles Heteroaromatic compounds Vinyl fluorides Fluoroalkenes Dialkylamines Azacyclic compounds Organopnictogen compounds Organofluorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Indole - Halobenzene - Fluorobenzene - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Pyrroline - Pyrrole - Azacycle - Fluoroalkene - Haloalkene - Vinyl halide - Vinyl fluoride - Secondary amine - Secondary aliphatic amine - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organohalogen compound - Amine - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as indoles. These are compounds containing an indole moiety, which consists of pyrrole ring fused to benzene to form 2,3-benzopyrrole.
• 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