Chemical Properties of 2-Furoic acid, benzyldimethylsilyl ester

InChI

InChI=1S/C14H16O3Si/c1-18(2,11-12-7-4-3-5-8-12)17-14(15)13-9-6-10-16-13/h3-10H,11H2,1-2H3

InChI Key

BDQGQJNOZAYAHZ-UHFFFAOYSA-N

Formula

C14H16O3Si

SMILES

C[Si](C)(Cc1ccccc1)OC(=O)c1ccco1

Molecular Weight¹

260.36

• 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.
• 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	0.6010		Relay (1.0) Calculated Property
ΔfG°	-100.24	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-428.01	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	83.39	kJ/mol	Relay (1.0) Calculated Property
IE	8.64	eV	Relay (1.0) Calculated Property
log10WS	-3.30		Relay (1.0) Calculated Property
logPoct/wat	3.423		Crippen Calculated Property
Pc	1911.58	kPa	Relay (1.0-beta) Calculated Property
Inp	[1775.00; 1775.00]
Inp	1775.00		NIST
Inp	1775.00		NIST
Tboil	591.55	K	Relay (1.0) Calculated Property
Tc	806.91	K	Relay (1.0) Calculated Property
Tfus	292.55	K	Relay (1.0) Calculated Property
Vc	0.772	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to 2-Furoic acid, benzyldimethylsilyl 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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