Chemical Properties of Pyridine, 4-acetyl-2-(1-methylethenyl)

InChI

InChI=1S/C10H11NO/c1-7(2)10-6-9(8(3)12)4-5-11-10/h4-6H,1H2,2-3H3

InChI Key

RYNRLVOZUDLPQK-UHFFFAOYSA-N

Formula

C10H11NO

SMILES

C=C(C)c1cc(C(C)=O)ccn1

Molecular Weight¹

161.20

• 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.
• 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	0.5068		Relay (... Calculated Property
ΔfG°	86.94	kJ/mol	Relay (... Calculated Property ⚠️
ΔfH°gas	-43.52	kJ/mol	Relay (... Calculated Property
ΔvapH°	68.07	kJ/mol	Relay (... Calculated Property
IE	9.16	eV	Relay (... Calculated Property
log10WS	-1.77		Relay (... Calculated Property
logPoct/wat	2.317		Crippen Calculated Property
McVol	135.250	ml/mol	McGowan Calculated Property
Pc	3265.40	kPa	Relay (... Calculated Property ⚠️
Inp	[1331.00; 1333.00]
Inp	1331.00		NIST
Inp	1333.00		NIST
Inp	1331.00		NIST
Tboil	529.45	K	Relay (... Calculated Property
Tc	755.45	K	Relay (... Calculated Property
Tfus	340.73	K	Relay (... Calculated Property
Vc	0.503	m3/kmol	Relay (... Calculated Property

Similar Compounds

Find more compounds similar to Pyridine, 4-acetyl-2-(1-methylethenyl).

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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