Chemical Properties of 2-Decenal, 4,5-epoxy, PFBO

InChI

InChI=1S/C17H18F5NO2/c1-2-3-4-6-11-12(25-11)7-5-8-23-24-9-10-13(18)15(20)17(22)16(21)14(10)19/h5,7-8,11-12H,2-4,6,9H2,1H3/b7-5+,23-8+

InChI Key

XWSHGXHSCROHSI-JNVYPNFTSA-N

Formula

C17H18F5NO2

SMILES

CCCCCC1OC1C=CC=NOCc1c(F)c(F)c(F)c(F)c1F

Molecular Weight¹

363.32

• 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.
• 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	-1207.90	kJ/mol	Joback Calculated Property
ΔvapH°	64.73	kJ/mol	Joback Calculated Property
log10WS	-6.50		Crippen Calculated Property
logPoct/wat	4.788		Crippen Calculated Property
McVol	237.740	ml/mol	McGowan Calculated Property
Pc	1274.60	kPa	Joback Calculated Property
Inp	[2074.00; 2074.00]
Inp	2074.00		NIST
Inp	2074.00		NIST
Tboil	768.57	K	Joback Calculated Property
Tc	957.10	K	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-Decenal, 4,5-epoxy, PFBO.

Sources

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

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