Chemical Properties of (.+/-.)-Lavandulol, picolinyloxydimethylsilyl ether

InChI

InChI=1S/C18H29NO2Si/c1-15(2)9-10-18(16(3)4)14-21-22(5,6)20-13-17-8-7-11-19-12-17/h7-9,11-12,18H,3,10,13-14H2,1-2,4-6H3

InChI Key

NDUIOFABYIXWSY-UHFFFAOYSA-N

Formula

C18H29NO2Si

SMILES

C=C(C)C(CC=C(C)C)CO[Si](C)(C)OCc1cccnc1

Molecular Weight¹

319.51

• 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	0.6076		Relay (... Calculated Property
ΔfG°	134.42	kJ/mol	Relay (... Calculated Property ⚠️
ΔfH°gas	-380.62	kJ/mol	Relay (... Calculated Property
ΔvapH°	81.68	kJ/mol	Relay (... Calculated Property
IE	8.99	eV	Relay (... Calculated Property
log10WS	-3.12		Relay (... Calculated Property
logPoct/wat	4.865		Crippen Calculated Property
Pc	1303.95	kPa	Relay (... Calculated Property ⚠️
Inp	[1974.50; 1974.50]
Inp	1974.50		NIST
Inp	1974.50		NIST
Tboil	608.87	K	Relay (... Calculated Property
Tc	802.07	K	Relay (... Calculated Property
Tfus	250.30	K	Relay (... Calculated Property
Vc	0.994	m3/kmol	Relay (... Calculated Property

Similar Compounds

Find more compounds similar to (.+/-.)-Lavandulol, picolinyloxydimethylsilyl ether.

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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