Chemical Properties of Phenyllactic acid, 4-methoxy, TMS

InChI

InChI=1S/C16H28O4Si2/c1-18-14-10-8-13(9-11-14)12-15(19-21(2,3)4)16(17)20-22(5,6)7/h8-11,15H,12H2,1-7H3

InChI Key

KRIUQGLSCSYUOA-UHFFFAOYSA-N

Formula

C16H28O4Si2

SMILES

COc1ccc(CC(O[Si](C)(C)C)C(=O)O[Si](C)(C)C)cc1

Molecular Weight¹

340.56

• 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	0.7028		Relay (... Calculated Property
ΔfG°	-298.03	kJ/mol	Relay (... Calculated Property ⚠️
ΔfH°gas	-898.31	kJ/mol	Relay (... Calculated Property
ΔvapH°	82.57	kJ/mol	Relay (... Calculated Property
IE	8.25	eV	Relay (... Calculated Property
log10WS	-2.63		Relay (... Calculated Property
logPoct/wat	3.836		Crippen Calculated Property
Pc	1005.05	kPa	Relay (... Calculated Property ⚠️
Inp	[1793.00; 1793.00]
Inp	1793.00		NIST
Inp	1793.00		NIST
Tboil	583.80	K	Relay (... Calculated Property
Tc	767.47	K	Relay (... Calculated Property
Tfus	298.79	K	Relay (... Calculated Property
Vc	1.059	m3/kmol	Relay (... Calculated Property

Similar Compounds

Find more compounds similar to Phenyllactic acid, 4-methoxy, TMS.

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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