GRADE & PURITY Analytical standard

Synonyms

2-[(4-Amino-3,5-dichloro-6-fluoro-2-pyridinyl)oxy]acetic Acid | EINECS Annex I Index 607-255-00-2 | Fluroxypyr, PESTANAL(R), analytical standard | Advance | Fluroxypyr | SCHEMBL23545 | HSDB 6655 | 2-(4-amino-3,5-dichloro-6-fluoropyridin-2-yloxy)acetic aci

Storage

Store at 2-8°C

Shipped In

Wet ice

Overview

Fluroxypyr is a systemic and selective herbicide. Fluroxypyr is used for the control of broad-leaved weeds in small grain cereals, maize, pastures, range land and turf. Fluroxypyr is a synthetic auxin.
A systemic and selective herbicide.

Specifications

Synonyms

2-[(4-Amino-3, 5-dichloro-6-fluoro-2-pyridinyl)oxy]acetic Acid | EINECS Annex I Index 607-255-00-2 | Fluroxypyr, PESTANAL(R), analytical standard | Advance | Fluroxypyr | SCHEMBL23545 | HSDB 6655 | 2-(4-amino-3, 5-dichloro-6-fluoropyridin-2-yloxy)acetic aci

Specifications & Purity

analytical standard

Storage

Store at 2-8°C

Shipped In

Wet ice

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

Grade

Analytical standard

Names and Identifiers

• Canonical Smiles: C(C(=O)O)OC1=NC(=C(C(=C1Cl)N)Cl)F
• IUPAC Name: 2-(4-amino-3,5-dichloro-6-fluoropyridin-2-yl)oxyacetic acid
• InChIKey: MEFQWPUMEMWTJP-UHFFFAOYSA-N
• INCHI: 1S/C7H5Cl2FN2O3/c8-3-5(11)4(9)7(12-6(3)10)15-1-2(13)14/h1H2,(H2,11,12)(H,13,14)
• Isomeric SMILES: C(C(=O)O)OC1=NC(=C(C(=C1Cl)N)Cl)F
• WGK Germany: 2
• Molecular Weight: 255.03
• Beilstein: 7136185
• Reaxy-Rn: 7136185
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=7136185&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Pyridines and derivatives
• Subclass: Halopyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: Polyhalopyridines
• Alternative Parents: 2-halopyridines Alkyl aryl ethers Aminopyridines and derivatives Aryl chlorides Aryl fluorides Heteroaromatic compounds Amino acids Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Organopnictogen compounds Primary amines Organic oxides Organochlorides Carbonyl compounds Organofluorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Polyhalopyridine - Alkyl aryl ether - Aminopyridine - 2-halopyridine - Aryl chloride - Aryl fluoride - Aryl halide - Heteroaromatic compound - Amino acid or derivatives - Amino acid - Azacycle - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Primary amine - Organic oxide - Organopnictogen compound - Organic oxygen compound - Hydrocarbon derivative - Amine - Aromatic heteromonocyclic compound
• Description: 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: Pyridine herbicides

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

Associated Targets(Human)

THRB Tclin Thyroid hormone receptor beta-1 (7926 Activities)

Discover Target: THRB

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Chemical and Physical Properties

• Melt Point(°C): 232℃
• Molecular Weight: 255.030 g/mol
• XLogP3: 1.800
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 253.966 Da
• Monoisotopic Mass: 253.966 Da
• Topological Polar Surface Area: 85.400 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 246.000
• 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