Diniconazole
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Category | Antifungal |
Catalog number | BBF-05840 |
CAS | 83657-24-3 |
Molecular Weight | 326.22 |
Molecular Formula | C15H17Cl2N3O |
Purity | ≥95% |
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Description
Diniconazol is a chemical compound belonging to chlorine group of conazole. It is used as a fungicide. It inhibited lanosterol 14 alpha-demethylation catalyzed by a yeast cytochrome P-450 strongly.
Specification
Related CAS | 76714-88-0 (Deleted CAS) 101179-53-7 (Deleted CAS) 1135441-04-1 (Deleted CAS) 70217-36-6 (rac-isomer) 76714-16-4 (Z-isomer) |
Synonyms | (E)-(±)-β-[(2,4-Dichlorophenyl)methylene]-α-(1,1-dimethylethyl)-1H-1,2,4-triazole-1-ethanol; (E)-1-(2,4-Dichlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)-1-penten-3-ol; (E)-β-[(2,4-Dichlorophenyl)methylene]-α-(1,1-dimethylethyl)-1H-1,2,4-triazole-1-ethanol; Mixor; Nb 2; Rac-diniconazole; S 3308; S 3308-10; S 3308L; Spotless; Sumi; Sumi 8; Sumi 8-020FS; Sumi 8-12.5WP; XE 779; 1H-1,2,4-Triazole-1-ethanol, β-[(2,4-dichlorophenyl)methylene]-α-(1,1-dimethylethyl)-, (βE)- |
Shelf Life | Limited shelf life, expiry date on the label |
Storage | Store at -20°C |
IUPAC Name | (E)-1-(2,4-dichlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-ol |
Canonical SMILES | CC(C)(C)C(C(=CC1=C(C=C(C=C1)Cl)Cl)N2C=NC=N2)O |
InChI | InChI=1S/C15H17Cl2N3O/c1-15(2,3)14(21)13(20-9-18-8-19-20)6-10-4-5-11(16)7-12(10)17/h4-9,14,21H,1-3H3/b13-6+ |
InChI Key | FBOUIAKEJMZPQG-AWNIVKPZSA-N |
Properties
Appearance | White to Off-white Solid |
Application | Pesticide |
Antibiotic Activity Spectrum | Fungi |
Boiling Point | 501.1±60.0°C at 760 mmHg |
Melting Point | 148-149°C |
Density | 1.27±0.1 g/cm3 |
Solubility | Soluble in DMSO (Slightly), Methanol (Sparingly) |
Toxicity
Carcinogenicity | No indication of carcinogenicity to humans (not listed by IARC). |
Reference Reading
Spectrum
Predicted LC-MS/MS Spectrum - 10V, Positive
Experimental Conditions
Collision Energy: 10 eV
Instrument Type: QTOF (generic), spectrum predicted by CFM-ID
Mass Resolution: 0.0001 Da
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Bio Calculators
* Our calculator is based on the following equation:
Concentration (start) x Volume (start) = Concentration (final) x Volume (final)
It is commonly abbreviated as: C1V1 = C2V2