Simeconazole
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Simeconazole
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CAS No:
149508-90-7
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Formula:
C14H20FN3OSi
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Chemical Name:
Simeconazole
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Synonyms:
1H-1,2,4-Triazole-1-ethanol,α-(4-fluorophenyl)-α-[(trimethylsilyl)methyl]-;α-(4-Fluorophenyl)-α-[(trimethylsilyl)methyl]-1H-1,2,4-triazole-1-ethanol;F 155;F 155 (pesticide);Simeconazole;Sipconazole;Sanlit;Mogarit;1135441-17-6
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CAS No:
Description
2-(4-fluorophenyl)-1-(1,2,4-triazol-1-yl)-3-(trimethylsilyl)propan-2-ol is a member of the class of triazoles that is 2-(4-fluorophenyl)-1-(1,2,4-triazol-1-yl)-3-(trimethylsilyl)propane carrying an additional hydroxy substituent at position 2. It is a member of triazoles, a member of monofluorobenzenes, an organosilicon compound and a tertiary alcohol.
Safety Information
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 194 companies from 1 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:293.41
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:293.13596697
Monoisotopic Mass:293.13596697
Topological Polar Surface Area:50.9
Heavy Atom Count:20
Complexity:318
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
