Chemical Properties of 2-Phenoxypropionic acid, TBDMS

InChI

InChI=1S/C15H24O3Si/c1-12(17-13-10-8-7-9-11-13)14(16)18-19(5,6)15(2,3)4/h7-12H,1-6H3

InChI Key

BNTPVIZLSIFRPF-UHFFFAOYSA-N

Formula

C15H24O3Si

SMILES

CC(Oc1ccccc1)C(=O)O[Si](C)(C)C(C)(C)C

Molecular Weight¹

280.43

• 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	0.5729		Relay (... Calculated Property
ΔfG°	-200.45	kJ/mol	Relay (... Calculated Property ⚠️
ΔfH°gas	-663.66	kJ/mol	Relay (... Calculated Property
ΔvapH°	72.52	kJ/mol	Relay (... Calculated Property
IE	8.59	eV	Relay (... Calculated Property
log10WS	-3.30		Relay (... Calculated Property
logPoct/wat	4.002		Crippen Calculated Property
Pc	1740.79	kPa	Relay (... Calculated Property ⚠️
Inp	[1618.00; 1618.00]
Inp	1618.00		NIST
Inp	1618.00		NIST
Tboil	548.95	K	Relay (... Calculated Property
Tc	763.87	K	Relay (... Calculated Property
Tfus	342.18	K	Relay (... Calculated Property
Vc	0.856	m3/kmol	Relay (... Calculated Property

Similar Compounds

Find more compounds similar to 2-Phenoxypropionic acid, TBDMS.

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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