Chemical Properties of GA20-15-ene, Me-TMS

InChI

InChI=1S/C23H34O5Si/c1-14-12-21-13-22(14,28-29(4,5)6)11-8-15(21)23-10-7-9-20(2,19(25)27-23)17(23)16(21)18(24)26-3/h12,15-17H,7-11,13H2,1-6H3/t15-,16-,17-,20-,21+,22+,23-/m0/s1

InChI Key

LQQPMSFHYIQPQS-HHBZDXFNSA-N

Formula

C23H34O5Si

SMILES

COC(=O)C1C2C3(C)CCCC2(OC3=O)C2CCC3(O[Si](C)(C)C)CC12C=C3C

Molecular Weight¹

418.60

• 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	0.6102		Relay (1.0) Calculated Property
ΔfG°	-332.55	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-979.12	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	105.07	kJ/mol	Relay (1.0) Calculated Property
IE	8.68	eV	Relay (1.0) Calculated Property
log10WS	-3.66		Relay (1.0) Calculated Property
logPoct/wat	4.228		Crippen Calculated Property
Pc	724.22	kPa	Relay (1.0-beta) Calculated Property
Inp	[2432.00; 2432.00]
Inp	2432.00		NIST
Inp	2432.00		NIST
Tboil	646.41	K	Relay (1.0) Calculated Property
Tc	946.99	K	Relay (1.0) Calculated Property
Tfus	366.54	K	Relay (1.0) Calculated Property
Vc	1.236	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to GA20-15-ene, Me-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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