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Triclopyr ester

CAT: 0804-HY-W710697-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-W710697-01Size:5 mg
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Description
Triclopyr ester (Triclopyr 2-butoxyethylester) is a bioactive substance with activity in controlling harmful woody plants. Triclopyr ester showed toxicity to honeybees (Apis mellifera) in greenhouse trials. Triclopyr ester in combination with other herbicides is effective in removing the canopy of plants such as honey trees and whitebrush. Triclopyr ester can quickly assess its weeding effectiveness when treating trees in greenhouses, providing potential treatment options for field experiments[1].
CAS Number
64700-56-7
Product Name Alternative
Triclopyr 2-butoxyethylester
UNSPSC
12352005
Hazard Statement
H302-H315-H410
Target
Herbicide
Type
Reference compound
Related Pathways
Metabolic Enzyme/Protease
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/triclopyr-ester.html
Smiles
O=C(COC1=NC(Cl)=C(C=C1Cl)Cl)OCCOCCCC
Molecular Formula
C13H16Cl3NO4
Molecular Weight
356.63
Precautions
P264-P270-P273-P280-P302+P352-P330-P362+P364-P391-P501
References & Citations
[1]Potential Herbicides for Brush Control
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Triclopyr-butotyl
CAS Number64700-56-7
PubChem CID47455
IUPAC Name2-butoxyethyl 2-[(3,5,6-trichloro-2-pyridinyl)oxy]acetate
Molecular FormulaC13H16Cl3NO4
Molecular Weight356.6
XLogP4.4
Topological Polar Surface Area57.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count10
Heavy Atom Count21
Formal Charge0
Complexity309
SMILES
CCCCOCCOC(=O)COC1=NC(=C(C=C1Cl)Cl)Cl
InChI
InChI=1S/C13H16Cl3NO4/c1-2-3-4-19-5-6-20-11(18)8-21-13-10(15)7-9(14)12(16)17-13/h7H,2-6,8H2,1H3
InChIKey
IVDRCZNHVGQBHZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Triclopyr-butotyl
CAS: 64700-56-7
CID: 47455
Formula: C13H16Cl3NO4
MW: 356.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight356.6
XLogP34.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count10
Exact Mass355.014491
Monoisotopic Mass355.014491
Topological Polar Surface Area57.7 Ų
Heavy Atom Count21
Formal Charge0
Complexity309
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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