Chemical Properties of Nonadecanoic acid, 1,3-bis-(OTMS) propyl ester («beta»-glyceryl nonadecanoate)

InChI

InChI=1S/C28H60O4Si2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-28(29)32-27(25-30-33(2,3)4)26-31-34(5,6)7/h27H,8-26H2,1-7H3

InChI Key

VCUOFTYKETZLHD-UHFFFAOYSA-N

Formula

C28H60O4Si2

SMILES

CCCCCCCCCCCCCCCCCCC(=O)OC(CO[Si](C)(C)C)CO[Si](C)(C)C

Molecular Weight¹

516.94

• 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	1.2074		Relay (... Calculated Property
ΔfG°	-286.00	kJ/mol	Relay (... Calculated Property ⚠️
ΔfH°gas	-1394.29	kJ/mol	Relay (... Calculated Property
ΔvapH°	120.59	kJ/mol	Relay (... Calculated Property
IE	9.99	eV	Relay (... Calculated Property
log10WS	-7.60		Relay (... Calculated Property
logPoct/wat	9.253		Crippen Calculated Property
Pc	-72.70	kPa	Relay (... Calculated Property ⚠️
Inp	[2864.00; 2868.00]
Inp	2868.00		NIST
Inp	2864.00		NIST
Inp	2868.00		NIST
Tboil	660.10	K	Relay (... Calculated Property
Tc	818.81	K	Relay (... Calculated Property
Tfus	285.26	K	Relay (... Calculated Property
Vc	1.857	m3/kmol	Relay (... Calculated Property

Similar Compounds

Find more compounds similar to Nonadecanoic acid, 1,3-bis-(OTMS) propyl ester («beta»-glyceryl nonadecanoate).

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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