Chemical Properties of 1H-Imidazole, 5-methyl-1-pentyl

InChI

InChI=1S/C9H16N2/c1-3-4-5-6-11-8-10-7-9(11)2/h7-8H,3-6H2,1-2H3

InChI Key

VNGZUUNTYHPODP-UHFFFAOYSA-N

Formula

C9H16N2

SMILES

CCCCCn1cncc1C

Molecular Weight¹

152.24

• 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.
• McVol : McGowan's characteristic volume (ml/mol).
• 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	0.5025		Relay (... Calculated Property
ΔfG°	251.32	kJ/mol	Relay (... Calculated Property ⚠️
ΔfH°gas	0.35	kJ/mol	Relay (... Calculated Property
ΔvapH°	64.76	kJ/mol	Relay (... Calculated Property
IE	8.60	eV	Relay (... Calculated Property
log10WS	-1.66		Relay (... Calculated Property
logPoct/wat	2.382		Crippen Calculated Property
McVol	138.170	ml/mol	McGowan Calculated Property
Pc	2819.17	kPa	Relay (... Calculated Property ⚠️
Inp	[1380.00; 1380.00]
Inp	1380.00		NIST
Inp	1380.00		NIST
I	[2083.00; 2083.00]
I	2083.00		NIST
I	2083.00		NIST
Tboil	547.37	K	Relay (... Calculated Property
Tc	714.98	K	Relay (... Calculated Property
Tfus	256.38	K	Relay (... Calculated Property
Vc	0.532	m3/kmol	Relay (... Calculated Property

Similar Compounds

Find more compounds similar to 1H-Imidazole, 5-methyl-1-pentyl.

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
• McGowan Method
• NIST Webbook

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