Chemical Properties of 2-Furoic acid, bromomethyldimethylsilyl ester

InChI

InChI=1S/C8H11BrO3Si/c1-13(2,6-9)12-8(10)7-4-3-5-11-7/h3-5H,6H2,1-2H3

InChI Key

ODMBKONZYFZQNF-UHFFFAOYSA-N

Formula

C8H11BrO3Si

SMILES

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

Molecular Weight¹

263.16

• 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	0.5788		Relay (1.0) Calculated Property
ΔfG°	-250.02	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-531.10	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	66.46	kJ/mol	Relay (1.0) Calculated Property
IE	9.25	eV	Relay (1.0) Calculated Property
log10WS	-2.78		Relay (1.0) Calculated Property
logPoct/wat	2.576		Crippen Calculated Property
Pc	2454.30	kPa	Relay (1.0-beta) Calculated Property
Inp	[1444.00; 1444.00]
Inp	1444.00		NIST
Inp	1444.00		NIST
Tboil	532.01	K	Relay (1.0) Calculated Property
Tc	720.45	K	Relay (1.0) Calculated Property
Tfus	273.24	K	Relay (1.0) Calculated Property
Vc	0.594	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to 2-Furoic acid, bromomethyldimethylsilyl 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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