Azoxystrobin
Category:
CAS:
Description:
Azoxystrobin is a systemic fungicide commonly used in agriculture. It is used as an active agent protecting plants and fruit/vegetables from fungal diseases. It inhibits mitochondrial respiration by blocking electron transfer between cytochromes b and c1.
| CID | 3034285 |
| Deprecated CAS | 215934-32-0, 296237-03-1, 918881-33-1 |
| Synonyms | Amistar; Bankit; Heritage; Quadris; methyl (E)-2-[2-[6-(2-cyanophenoxy)pyrimidin-4-yl]oxyphenyl]-3-methoxyprop-2-enoate |
| IUPAC Name | methyl (E)-2-[2-[6-(2-cyanophenoxy)pyrimidin-4-yl]oxyphenyl]-3-methoxyprop-2-enoate |
| Molecular Weight | 403.394 |
| Molecular Formula | C22H17N3O5 |
| Canonical SMILES | COC=C(C1=CC=CC=C1OC2=NC=NC(=C2)OC3=CC=CC=C3C#N)C(=O)OC |
| InChI | InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+ |
| InChIKey | WFDXOXNFNRHQEC-GHRIWEEISA-N |
| Isomeric SMILES | CO/C=C(\C1=CC=CC=C1OC2=NC=NC(=C2)OC3=CC=CC=C3C#N)/C(=O)OC |
| EC Number | 603-524-3 |
| UNII | NYH7Y08IPM |
Producut details
| Formulation | 20%WDG, 50%WDG, 80%WDG, 250K/LSC |
| Grade | 96%TC 97%TC 98%TC |
| Toxicity | Not Likely to be Carcinogenic to Humans. |
| Appearance | Pale Yellow Solid |
| Melting Point | 117-119°C |
| Water | In water, 6 mg/L at 20 °C |
| Shelf Life | Limited shelf life, expiry date on the label |
Chemical and Physical Properties
| Purity | >95% |
| Complexity | 646 |
| Exact Mass | 403.11682065 |
| Heavy Atom Count | 30 |
| Hydrogen Bond Acceptor Count | 8 |
| Hydrogen Bond Donor Count | 0 |
| Monoisotopic Mass | 403.11682065 |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 104 |
| XLogP3 | 3.7 |
QC Data
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