Chemical Properties of Silane, trimethyl[[5-methyl-2-(1-methylethenyl)-4-hexenyl]oxy]- (CAS 74498-96-7)

InChI

InChI=1S/C13H26OSi/c1-11(2)8-9-13(12(3)4)10-14-15(5,6)7/h8,13H,3,9-10H2,1-2,4-7H3

InChI Key

NGFKFXGBSQBUPT-UHFFFAOYSA-N

Formula

C13H26OSi

SMILES

C=C(C)C(CC=C(C)C)CO[Si](C)(C)C

Molecular Weight¹

226.43

CAS

74498-96-7

Other Names

• (.+/-.)-Lavandulol, trimethylsilyl ether
• [(2-Isopropenyl-5-methyl-4-hexenyl)oxy](trimethyl)silane
• Lavandulol, 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	0.4256		Relay (1.0) Calculated Property
ΔfG°	52.22	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-386.47	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	56.01	kJ/mol	Relay (1.0) Calculated Property
IE	8.74	eV	Relay (1.0) Calculated Property
log10WS	-3.43		Relay (1.0) Calculated Property
logPoct/wat	4.386		Crippen Calculated Property
Pc	1499.06	kPa	Relay (1.0-beta) Calculated Property
Inp	[1234.30; 1234.30]
Inp	1234.30		NIST
Inp	1234.30		NIST
Tboil	502.34	K	Relay (1.0) Calculated Property
Tc	644.72	K	Relay (1.0) Calculated Property
Tfus	206.21	K	Relay (1.0) Calculated Property
Vc	0.770	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to Silane, trimethyl[[5-methyl-2-(1-methylethenyl)-4-hexenyl]oxy]-.

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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