Chemical Properties of Fluazifop-butyl (CAS 69806-50-4)

InChI

InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3

InChI Key

VAIZTNZGPYBOGF-UHFFFAOYSA-N

Formula

C19H20F3NO4

SMILES

CCCCOC(=O)C(C)Oc1ccc(Oc2ccc(C(F)(F)F)cn2)cc1

Molecular Weight¹

383.36

CAS

69806-50-4

Other Names

• Propanoic acid, 2-[4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenoxy]-, butyl ester
• Butyl 2-(4-(5-trifluoromethyl-2-pyridinyloxy)phenoxy)propanoate
• Fusilade
• IH 773B
• PP 009
• Propionic acid, 2-(p-((5-(trifluoromethyl)-2-pyridyl)oxy)phenoxy)-, butyl ester
• TF 1169
• 2-[4-[[5-(Trifluoromethyl)-2-pyridinyl]oxy]phenoxy]propanoic acid butyl ester
• Butyl 2-[4-(5-trifluoromethyl-2-pyridyloxy)phenoxy]propionate
• Fusilade W
• Halokon
• Onecide
• Fluazifop, butyl ester
• Fluazifop-P-butyl

• ω : Acentric Factor.
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.8506		Relay (1.0) Calculated Property
ΔfG°	-745.97	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-1225.99	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	93.08	kJ/mol	Relay (1.0) Calculated Property
IE	8.42	eV	Relay (1.0) Calculated Property
log10WS	-5.15		Relay (1.0) Calculated Property
logPoct/wat	5.003		Crippen Calculated Property
McVol	265.520	ml/mol	McGowan Calculated Property
Pc	1543.88	kPa	Relay (1.0-beta) Calculated Property
Inp	[2190.00; 2203.00]
Inp	2190.00		NIST
Inp	2203.00		NIST
Tboil	650.89	K	Relay (1.0) Calculated Property
Tc	865.81	K	Relay (1.0) Calculated Property
Tfus	346.94	K	Relay (1.0) Calculated Property
Vc	0.978	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to Fluazifop-butyl.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

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