Chemical Properties of Butyric acid, dimethyl(3,3,3-trifluoropropyl)silyl ester

InChI

InChI=1S/C9H17F3O2Si/c1-4-5-8(13)14-15(2,3)7-6-9(10,11)12/h4-7H2,1-3H3

InChI Key

SKNRKYZJVPBETQ-UHFFFAOYSA-N

Formula

C9H17F3O2Si

SMILES

CCCC(=O)O[Si](C)(C)CCC(F)(F)F

Molecular Weight¹

242.31

• ω : Acentric Factor.
• 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.
• 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	0.5572		Relay (1.0) Calculated Property
ΔvapH°	53.17	kJ/mol	Relay (1.0) Calculated Property
IE	10.37	eV	Relay (1.0) Calculated Property
log10WS	-2.38		Relay (1.0) Calculated Property
logPoct/wat	3.487		Crippen Calculated Property
Pc	1791.28	kPa	Relay (1.0-beta) Calculated Property
Inp	[1020.00; 1020.00]
Inp	1020.00		NIST
Inp	1020.00		NIST
Tboil	434.25	K	Relay (1.0) Calculated Property
Tc	589.18	K	Relay (1.0) Calculated Property
Tfus	203.86	K	Relay (1.0) Calculated Property
Vc	0.653	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

Find more compounds similar to Butyric acid, dimethyl(3,3,3-trifluoropropyl)silyl ester.

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
• NIST Webbook

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