| Size | Price | Stock | Qty |
|---|---|---|---|
| 100mg |
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| Other Sizes |
| References |
[1]. Wenbi Guan, et al. Dissipation of clodinafop-propargyl and its metabolite in wheat field ecosystem. Bull Environ Contam Toxicol. 2013 Jun;90(6):750-5.
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|---|---|
| Additional Infomation |
Clodinafop-propargyl is a carboxylic acid ester formed by the condensation of the carboxyl group of clodinafop with the hydroxyl group of propargyl-1-ol. It is widely used as a herbicide to control annual grass weeds in cereal crops. It has multiple functions, including as an EC 6.4.1.2 (acetyl-CoA carboxylase) inhibitor, herbicide, and agrochemical. It is a carboxylic acid ester, aromatic ether, organochlorine compound, organofluorine compound, pyridine compound, and propionamide compound. Its function is similar to that of propargyl-1-ol and clodinafop. Clodinafop-propargyl is used as a wheat herbicide. See also: clodinafop (note moved here).
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| Molecular Formula |
C17H13CLFNO4
|
|---|---|
| Molecular Weight |
349.74
|
| Exact Mass |
349.051
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| CAS # |
105512-06-9
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| Related CAS # |
Clodinafop-propargyl-13C6
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| PubChem CID |
92431
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| Appearance |
Off-white to yellow solid powder
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| Density |
1.3±0.1 g/cm3
|
| Boiling Point |
432.7±45.0 °C at 760 mmHg
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| Melting Point |
48-57ºC
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| Flash Point |
215.5±28.7 °C
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| Vapour Pressure |
0.0±1.0 mmHg at 25°C
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| Index of Refraction |
1.559
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| LogP |
2.33
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| Hydrogen Bond Donor Count |
0
|
| Hydrogen Bond Acceptor Count |
6
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| Rotatable Bond Count |
7
|
| Heavy Atom Count |
24
|
| Complexity |
461
|
| Defined Atom Stereocenter Count |
1
|
| SMILES |
ClC1C([H])=NC(=C(C=1[H])F)OC1C([H])=C([H])C(=C([H])C=1[H])O[C@@]([H])(C(=O)OC([H])([H])C#C[H])C([H])([H])[H]
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| InChi Key |
JBDHZKLJNAIJNC-LLVKDONJSA-N
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| InChi Code |
InChI=1S/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1
|
| Chemical Name |
prop-2-ynyl (2R)-2-[4-(5-chloro-3-fluoropyridin-2-yl)oxyphenoxy]propanoate
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| HS Tariff Code |
2934.99.9001
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| Storage |
Powder -20°C 3 years 4°C 2 years In solvent -80°C 6 months -20°C 1 month |
| Shipping Condition |
Room temperature (This product is stable at ambient temperature for a few days during ordinary shipping and time spent in Customs)
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| Solubility (In Vitro) |
DMSO: 100 mg/mL (285.93 mM)
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|---|---|
| Solubility (In Vivo) |
Solubility in Formulation 1: 2.5 mg/mL (7.15 mM) in 10% DMSO + 90% (20% SBE-β-CD in Saline) (add these co-solvents sequentially from left to right, and one by one), suspension solution; with sonication.
For example, if 1 mL of working solution is to be prepared, you can add 100 μL of 25.0 mg/mL clear DMSO stock solution to 900 μL of 20% SBE-β-CD physiological saline solution and mix evenly. Preparation of 20% SBE-β-CD in Saline (4°C，1 week): Dissolve 2 g SBE-β-CD in 10 mL saline to obtain a clear solution. Solubility in Formulation 2: ≥ 2.5 mg/mL (7.15 mM) (saturation unknown) in 10% DMSO + 90% Corn Oil (add these co-solvents sequentially from left to right, and one by one), clear solution. For example, if 1 mL of working solution is to be prepared, you can add 100 μL of 25.0 mg/mL clear DMSO stock solution to 900 μL of corn oil and mix evenly. (Please use freshly prepared in vivo formulations for optimal results.) |
| Preparing Stock Solutions | 1 mg | 5 mg | 10 mg | |
| 1 mM | 2.8593 mL | 14.2963 mL | 28.5927 mL | |
| 5 mM | 0.5719 mL | 2.8593 mL | 5.7185 mL | |
| 10 mM | 0.2859 mL | 1.4296 mL | 2.8593 mL |
*Note: Please select an appropriate solvent for the preparation of stock solution based on your experiment needs. For most products, DMSO can be used for preparing stock solutions (e.g. 5 mM, 10 mM, or 20 mM concentration); some products with high aqueous solubility may be dissolved in water directly. Solubility information is available at the above Solubility Data section. Once the stock solution is prepared, aliquot it to routine usage volumes and store at -20°C or -80°C. Avoid repeated freeze and thaw cycles.
Calculation results
Working concentration： mg/mL；
Method for preparing DMSO stock solution： mg drug pre-dissolved in μL DMSO (stock solution concentration mg/mL). Please contact us first if the concentration exceeds the DMSO solubility of the batch of drug.
Method for preparing in vivo formulation:：Take μL DMSO stock solution, next add μL PEG300, mix and clarify, next addμL Tween 80, mix and clarify, next add μL ddH2O，mix and clarify.
(1) Please be sure that the solution is clear before the addition of next solvent. Dissolution methods like vortex, ultrasound or warming and heat may be used to aid dissolving.
(2) Be sure to add the solvent(s) in order.
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