Chemical Properties of 3-Aminobenzoic acid, N,N-bis(acetyl)-, trimethylsilyl ester

InChI

InChI=1S/C14H19NO4Si/c1-10(16)15(11(2)17)13-8-6-7-12(9-13)14(18)19-20(3,4)5/h6-9H,1-5H3

InChI Key

UYOXLRMBUDZXOM-UHFFFAOYSA-N

Formula

C14H19NO4Si

SMILES

CC(=O)N(C(C)=O)c1cccc(C(=O)O[Si](C)(C)C)c1

Molecular Weight¹

293.39

• 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	0.7510		Relay (1.0) Calculated Property
ΔfG°	-256.74	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-788.88	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	79.29	kJ/mol	Relay (1.0) Calculated Property
IE	8.96	eV	Relay (1.0) Calculated Property
log10WS	-2.57		Relay (1.0) Calculated Property
logPoct/wat	2.578		Crippen Calculated Property
Pc	1492.94	kPa	Relay (1.0-beta) Calculated Property
Inp	[1897.00; 1897.00]
Inp	1897.00		NIST
Inp	1897.00		NIST
Tboil	587.78	K	Relay (1.0) Calculated Property
Tc	815.79	K	Relay (1.0) Calculated Property
Tfus	361.98	K	Relay (1.0) Calculated Property
Vc	0.858	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to 3-Aminobenzoic acid, N,N-bis(acetyl)-, 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

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