Chemical Properties of Decanoic acid, trimethylsilyl ester (CAS 55494-15-0)

InChI

InChI=1S/C13H28O2Si/c1-5-6-7-8-9-10-11-12-13(14)15-16(2,3)4/h5-12H2,1-4H3

InChI Key

FGTNBYWFNITQJR-UHFFFAOYSA-N

Formula

C13H28O2Si

SMILES

CCCCCCCCCC(=O)O[Si](C)(C)C

Molecular Weight¹

244.45

CAS

55494-15-0

Other Names

• Decanoic acid, tms derivative

• 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	0.6933		Relay (1.0) Calculated Property
ΔfG°	-220.65	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-747.28	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	67.81	kJ/mol	Relay (1.0) Calculated Property
IE	9.89	eV	Relay (1.0) Calculated Property
log10WS	-4.35		Relay (1.0) Calculated Property
logPoct/wat	4.505		Crippen Calculated Property
Pc	1269.31	kPa	Relay (1.0-beta) Calculated Property
Inp	[1446.00; 1462.00]
Inp	1446.00		NIST
Inp	1450.00		NIST
Inp	1453.00		NIST
Inp	1450.00		NIST
Inp	1450.00		NIST
Inp	1453.00		NIST
Inp	1449.90		NIST
Inp	1455.00		NIST
Inp	1451.00		NIST
Inp	1453.00		NIST
Inp	1450.00		NIST
Inp	1460.00		NIST
Inp	Outlier 1462.00		NIST
Inp	1446.00		NIST
Inp	1453.00		NIST
Inp	1460.00		NIST
Tboil	510.59	K	Relay (1.0) Calculated Property
Tc	675.67	K	Relay (1.0) Calculated Property
Tfus	243.49	K	Relay (1.0) Calculated Property
Vc	0.884	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to Decanoic acid, trimethylsilyl 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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Outlier This icon means that the value is more than 2 standard deviations away from the property mean.