Chemical Properties of 2,8,9-Trioxa-5-aza-1-silabicyclo[3.3.3]undecane, 1-ethenyl- (CAS 2097-18-9)

InChI

InChI=1S/C8H15NO3Si/c1-2-13-10-6-3-9(4-7-11-13)5-8-12-13/h2H,1,3-8H2

InChI Key

JETUZEFHWCTPQD-UHFFFAOYSA-N

Formula

C8H15NO3Si

SMILES

C=C[Si]12OCCN(CCO1)CCO2

Molecular Weight¹

201.30

CAS

2097-18-9

Other Names

• 1-Vinylsilatrane
• Vinylsilatrane
• 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 1-vinyl-
• Vinylsilatran
• 1-Vinyl-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane

• 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.
• I : 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	0.3813		Relay (... Calculated Property
ΔfG°	-65.36	kJ/mol	Relay (... Calculated Property ⚠️
ΔfH°gas	-498.02	kJ/mol	Relay (... Calculated Property
ΔvapH°	54.30	kJ/mol	Relay (... Calculated Property
IE	8.50 ± 0.10	eV	NIST
log10WS	0.20		Relay (... Calculated Property
logPoct/wat	0.030		Crippen Calculated Property
Pc	2884.25	kPa	Relay (... Calculated Property ⚠️
Inp	[1522.00; 1522.00]
Inp	1522.00		NIST
Inp	1522.00		NIST
I	2580.00		NIST
Tboil	502.41	K	Relay (... Calculated Property
Tc	732.91	K	Relay (... Calculated Property
Tfus	357.55	K	Relay (... Calculated Property
Vc	0.531	m3/kmol	Relay (... Calculated Property

Similar Compounds

Find more compounds similar to 2,8,9-Trioxa-5-aza-1-silabicyclo[3.3.3]undecane, 1-ethenyl-.

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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