Chemical Properties of Flutriafol (CAS 76674-21-0)

InChI

InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2

InChI Key

JWUCHKBSVLQQCO-UHFFFAOYSA-N

Formula

C16H13F2N3O

SMILES

OC(Cn1cncn1)(c1ccc(F)cc1)c1ccccc1F

Molecular Weight¹

301.29

CAS

76674-21-0

Other Names

• (±)-a-(2-fluorophenyl)-a-(4-fluorophenyl)-1H-1,2,4-triazole-1-ethanol
• (±)-a-(2-fluorophenyl)-a-(4-fluorophenyl)-1H-1,2,4-triazole-1-ethanol
• .alpha.-(2-fluorophenyl)-.alpha.-(4-fluorophenyl)-1H-1,2,4-triazole-1-ethanol
• 1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1,2,4-triazol-1-yl)ethanol
• 1H-1,2,4-Triazole-1-ethanol, «alpha»-(2-fluorophenyl)-«alpha»-(4-fluorophenyl)-
• 1H-1,2,4-Triazole-1-ethanol, «alpha»-(2-fluorophenyl)-«alpha»-(4-fluorophenyl)-
• Impact
• PP 450
• R 152450
• «alpha»-(2-Fluorophenyl)-«alpha»-(4-fluorophenyl)-1H-1,2,4-triazole-1-ethanol
• «alpha»-(2-Fluorophenyl)-«alpha»-(4-fluorophenyl)-1H-1,2,4-triazole-1-ethanol

• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
log10WS	[-3.37; -3.37]
log10WS	-3.37		Aq. Sol...
log10WS	-3.37		Estimat...
logPoct/wat	2.492		Crippen Calculated Property
McVol	208.670	ml/mol	McGowan Calculated Property
Inp	[2152.00; 2157.00]
Inp	2157.00		NIST
Inp	2152.00		NIST
Inp	2157.00		NIST

Similar Compounds

Find more compounds similar to Flutriafol.

Mixtures

• Flutriafol + Norflurane

Sources

• Crippen Method
• Measurement and Correlation of the Solubilities of Azoxystrobin, Flutriafol, and Tebuconazole in Subcritical 1,1,1,2-Tetrafluoroethane
• Aqueous Solubility Prediction Method
• Estimated Solubility Method
• McGowan Method
• NIST Webbook

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