Chemical Properties of Hexadecandioic acid, bis(tert-butyldimethylsilyl) ester

InChI

InChI=1S/C28H58O4Si2/c1-27(2,3)33(7,8)31-25(29)23-21-19-17-15-13-11-12-14-16-18-20-22-24-26(30)32-34(9,10)28(4,5)6/h11-24H2,1-10H3

InChI Key

CCEXWIDNWFSMFB-UHFFFAOYSA-N

Formula

C28H58O4Si2

SMILES

CC(C)(C)[Si](C)(C)OC(=O)CCCCCCCCCCCCCCC(=O)O[Si](C)(C)C(C)(C)C

Molecular Weight¹

514.93

Other Names

• Bis[tert-butyl(dimethyl)silyl] hexadecanedioate
• Hexadecanedioic acid, 2tbdms derivative

• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔvapH°	110.47	kJ/mol	Relay (1.0) Calculated Property
log10WS	-7.33		Relay (1.0) Calculated Property
logPoct/wat	9.545		Crippen Calculated Property
Pc	500.12	kPa	Relay (1.0-beta) Calculated Property
Inp	[3065.90; 3065.90]
Inp	3065.90		NIST
Inp	3065.90		NIST
Tboil	634.07	K	Relay (1.0) Calculated Property
Tc	856.14	K	Relay (1.0) Calculated Property
Tfus	338.66	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

Find more compounds similar to Hexadecandioic acid, bis(tert-butyldimethylsilyl) 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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Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
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