Chemical Properties of Silane, trimethyl[[5-methyl-2-(1-methylethenyl)cyclohexyl]oxy]-, [1R-(1«alpha»,2«beta»,5«alpha»)]- (CAS 57396-86-8)

InChI

InChI=1S/C13H26OSi/c1-10(2)12-8-7-11(3)9-13(12)14-15(4,5)6/h11-13H,1,7-9H2,2-6H3

InChI Key

GYFMQJWVDAIXLJ-UHFFFAOYSA-N

Formula

C13H26OSi

SMILES

C=C(C)C1CCC(C)CC1O[Si](C)(C)C

Molecular Weight¹

226.43

CAS

57396-86-8

Other Names

• Isopulegol TMS

• 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	0.3846		Relay (... Calculated Property
ΔfG°	31.58	kJ/mol	Relay (... Calculated Property ⚠️
ΔfH°gas	-410.30	kJ/mol	Relay (... Calculated Property
ΔvapH°	55.89	kJ/mol	Relay (... Calculated Property
IE	9.07	eV	Relay (... Calculated Property
log10WS	-3.68		Relay (... Calculated Property
logPoct/wat	4.219		Crippen Calculated Property
Pc	1553.77	kPa	Relay (... Calculated Property ⚠️
Inp	[1220.70; 1220.70]
Inp	1220.70		NIST
Inp	1220.70		NIST
Tboil	510.28	K	Relay (... Calculated Property
Tc	671.75	K	Relay (... Calculated Property
Tfus	231.44	K	Relay (... Calculated Property
Vc	0.749	m3/kmol	Relay (... Calculated Property

Similar Compounds

Find more compounds similar to Silane, trimethyl[[5-methyl-2-(1-methylethenyl)cyclohexyl]oxy]-, [1R-(1«alpha»,2«beta»,5«alpha»)]-.

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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