Chemical Properties of Pyrimidine, 2-amino-6-hydroxy-4-methyl, TMS

InChI

InChI=1S/C11H23N3OSi2/c1-9-8-10(15-17(5,6)7)13-11(12-9)14-16(2,3)4/h8H,1-7H3,(H,12,13,14)

InChI Key

DJLWGKAKLBKEEO-UHFFFAOYSA-N

Formula

C11H23N3OSi2

SMILES

Cc1cc(O[Si](C)(C)C)nc(N[Si](C)(C)C)n1

Molecular Weight¹

269.49

• 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	0.5834		Relay (1.0) Calculated Property
ΔfG°	188.89	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-394.38	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	74.54	kJ/mol	Relay (1.0) Calculated Property
IE	8.53	eV	Relay (1.0) Calculated Property
log10WS	-3.23		Relay (1.0) Calculated Property
logPoct/wat	3.246		Crippen Calculated Property
Pc	1545.78	kPa	Relay (1.0-beta) Calculated Property
Inp	[1324.00; 1324.00]
Inp	1324.00		NIST
Inp	1324.00		NIST
Tboil	531.12	K	Relay (1.0) Calculated Property
Tc	762.17	K	Relay (1.0) Calculated Property
Tfus	365.78	K	Relay (1.0) Calculated Property
Vc	0.871	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to Pyrimidine, 2-amino-6-hydroxy-4-methyl, 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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