Chemical Properties of GA20, 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/h15-17H,1,7-13H2,2-6H3/t15?,16-,17?,20-,21+,22+,23-/m0/s1

InChI Key

ZXVZVLFTWHDLQN-LYIOEFPQSA-N

Formula

C23H34O5Si

SMILES

C=C1CC23CC1(O[Si](C)(C)C)CCC2C12CCCC(C)(C(=O)O1)C2C3C(=O)OC

Molecular Weight¹

418.60

Other Names

• GA20 methyl ester TMS ether
• Gibberellin GA20, methyl ester trimethylsilyl ether
• Gibberelline GA20, methyl ester TMS ether

• 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	0.6112		Relay (1.0) Calculated Property
ΔfG°	-323.36	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-983.17	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	107.56	kJ/mol	Relay (1.0) Calculated Property
IE	8.99	eV	Relay (1.0) Calculated Property
log10WS	-3.49		Relay (1.0) Calculated Property
logPoct/wat	4.228		Crippen Calculated Property
Pc	716.18	kPa	Relay (1.0-beta) Calculated Property
Inp	[2464.00; 2549.00]
Inp	2509.00		NIST
Inp	2510.00		NIST
Inp	2510.00		NIST
Inp	2513.00		NIST
Inp	2480.00		NIST
Inp	2502.00		NIST
Inp	2503.00		NIST
Inp	2480.00		NIST
Inp	2487.00		NIST
Inp	2490.00		NIST
Inp	2482.00		NIST
Inp	2509.00		NIST
Inp	2510.00		NIST
Inp	2510.00		NIST
Inp	2513.00		NIST
Inp	2487.00		NIST
Inp	2506.00		NIST
Inp	2509.00		NIST
Inp	2507.00		NIST
Inp	2508.00		NIST
Inp	2512.00		NIST
Inp	2468.00		NIST
Inp	2471.00		NIST
Inp	2471.00		NIST
Inp	2518.00		NIST
Inp	2523.00		NIST
Inp	2485.00		NIST
Inp	2485.00		NIST
Inp	2494.00		NIST
Inp	2496.00		NIST
Inp	2508.00		NIST
Inp	2510.00		NIST
Inp	Outlier 2549.00		NIST
Inp	Outlier 2549.00		NIST
Inp	2488.00		NIST
Inp	Outlier 2548.00		NIST
Inp	Outlier 2548.00		NIST
Inp	2482.00		NIST
Inp	2517.00		NIST
Inp	2517.00		NIST
Inp	2482.00		NIST
Inp	2485.00		NIST
Inp	2482.00		NIST
Inp	2493.00		NIST
Inp	2494.00		NIST
Inp	2485.00		NIST
Inp	2487.00		NIST
Inp	2501.00		NIST
Inp	2501.00		NIST
Inp	2490.00		NIST
Inp	2491.00		NIST
Inp	2492.00		NIST
Inp	2488.00		NIST
Inp	2488.00		NIST
Inp	2482.00		NIST
Inp	2492.00		NIST
Inp	2495.00		NIST
Inp	2496.00		NIST
Inp	2517.00		NIST
Inp	2517.00		NIST
Inp	2520.00		NIST
Inp	2521.00		NIST
Inp	2490.00		NIST
Inp	2499.00		NIST
Inp	2516.00		NIST
Inp	2517.00		NIST
Inp	2477.00		NIST
Inp	2478.00		NIST
Inp	2483.00		NIST
Inp	2502.00		NIST
Inp	2502.00		NIST
Inp	2502.00		NIST
Inp	2474.00		NIST
Inp	2482.00		NIST
Inp	2489.00		NIST
Inp	2479.00		NIST
Inp	2478.00		NIST
Inp	Outlier 2544.00		NIST
Inp	2464.00		NIST
Inp	2497.00		NIST
Inp	2534.00		NIST
Inp	2536.00		NIST
Inp	2520.00		NIST
Inp	2523.00		NIST
Inp	2529.00		NIST
Inp	2529.00		NIST
Inp	2482.00		NIST
Inp	2497.00		NIST
Inp	2497.00		NIST
Inp	2500.00		NIST
Inp	2500.00		NIST
Inp	Outlier 2543.00		NIST
Inp	2509.00		NIST
Inp	2476.00		NIST
Inp	2477.00		NIST
Inp	2509.00		NIST
Inp	2471.00		NIST
Inp	2468.00		NIST
Inp	2493.00		NIST
Inp	2509.00		NIST
Inp	2509.00		NIST
Inp	2511.00		NIST
Inp	2485.00		NIST
Inp	2468.00		NIST
Inp	2482.00		NIST
Inp	2482.00		NIST
Inp	2477.00		NIST
Inp	2477.00		NIST
Inp	2509.00		NIST
Inp	Outlier 2544.00		NIST
Inp	2520.00		NIST
Inp	2497.00		NIST
Inp	2468.00		NIST
Inp	2485.00		NIST
Inp	2477.00		NIST
Inp	2480.00		NIST
Inp	2490.00		NIST
Inp	2513.00		NIST
Inp	2508.00		NIST
Inp	2518.00		NIST
Tboil	663.51	K	Relay (1.0) Calculated Property
Tc	948.66	K	Relay (1.0) Calculated Property
Tfus	372.10	K	Relay (1.0) Calculated Property
Vc	1.228	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to GA20, 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

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.