Flupyrimin - ≥98% , CAS No.1689566-03-7

CAS: 1689566-03-7 Cat. No.: F650267 Summenformel: C₁₃H₉ClF₃N₃O Molekulargewicht: 315.68 EG-Nummer: 881-647-3 PubChem CID: 14127920

QUALITÄT & REINHEIT ≥98%

Synonyms

(N(E))-N-(1-((6-Chloro-3-pyridinyl)methyl)-2(1H)-pyridinylidene)-2,2,2-trifluoroacetamide | 1689566-03-7 | 1363400-41-2 | Flupyrimin 100 microg/mL in Acetonitrile | N-[1-((6-Chloropyridin-3-yl)methyl)pyridin-2(1H)-ylidene]-2,2,2-trifluoroacetamide | MS-24

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Übersicht

Flupyrimin acts as an antagonist at the insect nicotinic acetylcholine receptor (nAChR).

Form:Solid

Spezifikationen

Synonyme

(N(E))-N-(1-((6-Chloro-3-pyridinyl)methyl)-2(1H)-pyridinylidene)-2,2,2-trifluoroacetamide | 1689566-03-7 | 1363400-41-2 | Flupyrimin 100 microg/mL in Acetonitrile | N-[1-((6-Chloropyridin-3-yl)methyl)pyridin-2(1H)-ylidene]-2,2,2-trifluoroacetamide | MS-24

Spezifikationen & Reinheit

≥98%

Biochemische und physiologische Mechanismen

Flupyrimin acts as an antagonist at the insect nicotinic acetylcholine receptor (nAChR).

Storage

Store at -20°C

Verschickt in

Ice chest + Ice pads

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Aktionsart

INHIBITOR

Reinheit

≥98%

Namen und Kennungen

Kanonisches Lächeln

C1=CC(=NC(=O)C(F)(F)F)N(C=C1)CC2=CN=C(C=C2)Cl

IUPAC Name

N-[1-[(6-chloropyridin-3-yl)methyl]pyridin-2-ylidene]-2,2,2-trifluoroacetamide

InChIKey

DHQKLWKZSFCKTA-UHFFFAOYSA-N

INCHI

1S/C13H9ClF3N3O/c14-10-5-4-9(7-18-10)8-20-6-2-1-3-11(20)19-12(21)13(15,16)17/h1-7H,8H2

Isomere SMILES

C1=CC(=NC(=O)C(F)(F)F)N(C=C1)CC2=CN=C(C=C2)Cl

Alternative CAS-Nummer

1363400-41-2,1689566-03-7

PubChem CID

14127920

Molekulargewicht

315.68

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Pyridines and derivatives
      • Subclass Halopyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Pyridines and derivatives
• Subclass: Halopyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: Polyhalopyridines
• Alternative Parents: Dihydropyridines 2-halopyridines Heteroaromatic compounds N-acylimines Imidoyl chlorides Propargyl-type 1,3-dipolar organic compounds Carboxylic acids and derivatives Carboximidamides Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organofluorides Organochlorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Polyhalopyridine - 2-halopyridine - Dihydropyridine - Heteroaromatic compound - N-acylimine - Imidoyl halide - Imidoyl chloride - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organochloride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Aromatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as polyhalopyridines. These are organic compounds containing a pyridine ring substituted at two or more positions by a halogen atom.
• 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

Chemische und physikalische Eigenschaften

• Löslichkeit: DMSO : 250 mg/mL (791.94 mM; Need ultrasonic)
• Molekulargewicht: 315.680 g/mol
• XLogP3: 3.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 315.039 Da
• Monoisotopic Mass: 315.039 Da
• Topological Polar Surface Area: 45.600 Ų
• Heavy Atom Count: 21
• Formal Charge: 0
• Complexity: 488.000
• 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