Chemical Properties of trans-2-Hexenal oxime, o-[(pentafluorophenyl)methyl]-

InChI

InChI=1S/C13H12F5NO/c1-2-3-4-5-6-19-20-7-8-9(14)11(16)13(18)12(17)10(8)15/h4-6H,2-3,7H2,1H3/b5-4+,19-6?

InChI Key

UFLHMANGSVRSPF-VVILYHCASA-N

Formula

C13H12F5NO

SMILES

CCCC=CC=NOCc1c(F)c(F)c(F)c(F)c1F

Molecular Weight¹

293.23

Other Names

• (E)-2-Hexenal, PFBO # 2

• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• 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.
• I : Polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-1045.80	kJ/mol	Joback Calculated Property
ΔvapH°	51.72	kJ/mol	Joback Calculated Property
log10WS	-5.62		Crippen Calculated Property
logPoct/wat	4.241		Crippen Calculated Property
McVol	186.370	ml/mol	McGowan Calculated Property
Pc	1593.62	kPa	Joback Calculated Property
Inp	1522.00		NIST
I	[1910.00; 1910.00]
I	1910.00		NIST
I	1910.00		NIST
Tboil	648.03	K	Joback Calculated Property
Tc	829.81	K	Joback Calculated Property

Similar Compounds

Find more compounds similar to trans-2-Hexenal oxime, o-[(pentafluorophenyl)methyl]-.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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