Flurtamone (Standard) , CAS No.96525-23-4

CAS: 96525-23-4 Cat. No.: F1441591 Molecular Weight: 333.3 Beilstein Registry Number: 7543933 EC Number: 619-224-0 PubChem CID: 91755

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

Flurtamone (Standard) is the analytical standard of Flurtamone. This product is intended for research and analytical applications. Flurtamone is a chiral herbicide with acute toxicity levels to Selenastrum capricornutum.

Specifications

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

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

Names and Identifiers

• Canonical Smiles: CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F
• IUPAC Name: 5-(methylamino)-2-phenyl-4-[3-(trifluoromethyl)phenyl]furan-3-one
• InChIKey: NYRMIJKDBAQCHC-UHFFFAOYSA-N
• INCHI: 1S/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3
• Isomeric SMILES: CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F
• WGK Germany: 2
• RTECS: LU5105000
• PubChem CID: 91755
• Molecular Weight: 333.3
• Beilstein: 7543933

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Benzene and substituted derivatives
      • Subclass Trifluoromethylbenzenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Benzene and substituted derivatives
• Subclass: Trifluoromethylbenzenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Trifluoromethylbenzenes
• Alternative Parents: Furanones Vinylogous esters Vinylogous amides Ketene acetals Cyclic ketones Oxacyclic compounds Dialkylamines Organopnictogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Trifluoromethylbenzene - 3-furanone - Dihydrofuran - Vinylogous amide - Vinylogous ester - Ketene acetal or derivatives - Ketone - Cyclic ketone - Secondary aliphatic amine - Secondary amine - Oxacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Alkyl fluoride - Carbonyl group - Alkyl halide - Hydrocarbon derivative - Amine - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups.
• 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